SCHEMBL4145140

SCHEMBL4145140

Clc1ncc2[nH]ncc2n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.44
▸ TYRO3 Q06418 1/20 0.41
▸ DYRK1B Q9Y463 1/20 0.41
▸ NOS1 P29475 7/20 0.39
▸ DYRK1A Q13627 3/20 0.39
▸ ALDH1A1 P00352 2/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ HSP90AA1 P07900 1/20 0.35
▸ IDO1 P14902 1/20 0.35
▸ CDK2 P24941 1/20 0.35
▸ ABCB1 P08183 1/20 0.35
▸ CHEK1 O14757 1/20 0.33
▸ FGFR1 P11362 1/20 0.33
▸ MKNK1 Q9BUB5 1/20 0.32
▸ TRPA1 O75762 1/20 0.32
▸ PIK3CD O00329 1/20 0.32
▸ MEN1 O00255 2/20 0.31
▸ MAPT P10636 2/20 0.31
▸ KMT2A Q03164 2/20 0.31
▸ METAP2 P50579 2/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL15726868 0.74 DYRK1A (0.39) KDM4ENOS1DYRK1AALDH1A1HSP90AA1
SCHEMBL23530790 0.74 ALDH1A1 (0.44) KDM4ENOS1DYRK1AALDH1A1HSP90AA1
SCHEMBL3118472 0.74 DYRK1A (0.39) KDM4ENOS1DYRK1AALDH1A1HSP90AA1
SCHEMBL3117779 0.74 DYRK1A (0.39) KDM4ENOS1DYRK1AALDH1A1HSP90AA1
SCHEMBL5337466 0.74 DYRK1A (0.39) KDM4ENOS1DYRK1AALDH1A1HSP90AA1
SCHEMBL10806951 0.70 NOS1 (0.48) KDM4EDYRK1BNOS1DYRK1AALDH1A1
SCHEMBL22941856 0.69 DYRK1A (0.36) DYRK1AALDH1A1HSP90AA1IDO1CDK2
SCHEMBL3726365 0.69 DYRK1A (0.36) KDM4ENOS1DYRK1AALDH1A1HSP90AA1
SCHEMBL14629350 0.69 DYRK1A (0.36) DYRK1AALDH1A1HSP90AA1IDO1CDK2
SCHEMBL3120521 0.69 DYRK1A (0.36) DYRK1AHSP90AA1IDO1CDK2CHEK1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 89 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12630565-B2 DNA-dependent protein kinase inhibitor DIZAL (JIANGSU) PHARMACEUTICAL CO., LTD. (CN) 2026-05-19 — — US disclosed
WO-2025235874-A1 HETEROCYCLICS AS EGFR INHIBITORS SCHRÖDINGER, INC. (US) 2025-11-13 — — WO disclosed
US-12441731-B2 Pyrazolopyrimidine compounds and uses thereof INCYTE CORPORATION (US) 2025-10-14 — — US disclosed
US-20250304571-A1 BIOLOGICALLY ACTIVE COMPOUNDS AND METHODS THEREOF SUZHOU KEEN THERAPEUTICS CO., LTD. (CN) 2025-10-02 — — US disclosed
EP-4620959-A1 CYCLIC COMPOUNDS USED AS MULTI-TARGET KINASE INHIBITORS AND PREPARATION METHOD THEREFOR Shanghai Institute of Organic Chemistry, Chinese Academy of Sciences (CN) 2025-09-24 — — EP disclosed
EP-4565588-A1 BIOLOGICALLY ACTIVE COMPOUNDS AND METHODS THEREOF Suzhou Keen Therapeutics Co., Ltd. (CN) 2025-06-11 — — EP disclosed
CN-115768764-B Parallel ring compound with anti-tumor activity and application thereof 上海翊石医药科技有限公司 2025-02-07 — — CN disclosed
US-20240368127-A1 HSD17B13 INHIBITORS AND USES THEREOF FL2022-001, INC. 2024-11-07 — — US disclosed
US-20240182487-A1 MACROCYCLES AND THEIR USE BLOSSOMHILL THERAPEUTICS INC (US) 2024-06-06 — — US disclosed
US-20240182481-A1 PYRROLO[3,2-D]PYRIMIDINE COMPOUNDS AND METHODS OF USE IN THE TREATMENT OF CANCER TANGO THERAPEUTICS, INC. 2024-06-06 — — US disclosed
US-20120202785-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE F. HOFFMANN-LA ROCHE AG (CH) 2012-08-09 — — US disclosed
US-20120202785-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE F. HOFFMANN-LA ROCHE AG (CH) 2012-08-09 — — US disclosed
US-20120202785-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE F. HOFFMANN-LA ROCHE AG (CH) 2012-08-09 — — US disclosed
US-20090054397-A1 PYRAZOLE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE COMPOUND OHI NORIHITO 2009-02-26 — — US disclosed
US-7429609-B2 Pyrazole compound and medicinal composition containing the same EISAI R & D MANAGEMENT CO., LTD. (JP) 2008-09-30 — — US disclosed
US-7429609-B2 Pyrazole compound and medicinal composition containing the same EISAI R & D MANAGEMENT CO., LTD. (JP) 2008-09-30 — — US disclosed
US-7429609-B2 Pyrazole compound and medicinal composition containing the same EISAI R & D MANAGEMENT CO., LTD. (JP) 2008-09-30 — — US disclosed
US-20050261339-A1 Pyrazole compound and medicinal composition containing the same EISAI R&D MANAGEMENT CO., LTD. (JP) 2005-11-24 — — US disclosed
US-20050208582-A1 Pyrazole compounds and pharmaceutical compositions comprising the compound EISAI R&D MANAGEMENT CO., LTD. (JP) 2005-09-22 — — US disclosed
EP-1510516-A1 PYRAZOLE COMPOUND AND MEDICINAL COMPOSITION CONTAINING THE SAME Eisai Co., Ltd. (JP) 2005-03-02 — — EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (9 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-12630565-B2 DNA-dependent protein kinase inhibitor DCK, CHEK1, POLK KDM4E 859/4885TYRO3 1993/4885DYRK1B 277/4885
US-20120202785-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE PIK3CA, PIK3CD, AKT3 KDM4E 4269/4885TYRO3 1635/4885DYRK1B 2895/4885
US-12441731-B2 Pyrazolopyrimidine compounds and uses thereof ALK, FGFR1, FGFR2 KDM4E 1140/4885TYRO3 55/4885DYRK1B 3444/4885
US-20090054397-A1 PYRAZOLE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE COMPOUND CNKSR1, NR3C2, CSNK2B KDM4E 2622/4885TYRO3 1099/4885DYRK1B 268/4885
US-20050261339-A1 Pyrazole compound and medicinal composition containing the same CNKSR1, NR3C2, CSNK2B KDM4E 2795/4885TYRO3 970/4885DYRK1B 309/4885
US-20240182487-A1 MACROCYCLES AND THEIR USE VHL, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, DLD KDM4E 3077/4885TYRO3 3214/4885DYRK1B 4371/4885
US-20240182481-A1 PYRROLO[3,2-D]PYRIMIDINE COMPOUNDS AND METHODS OF USE IN THE TREATMENT OF CANCER DPYD, TYMS, TYMP KDM4E 3769/4885TYRO3 2217/4885DYRK1B 1275/4885
US-20250304571-A1 BIOLOGICALLY ACTIVE COMPOUNDS AND METHODS THEREOF VHL, BRCA1, TERT KDM4E 2102/4885TYRO3 2606/4885DYRK1B 4766/4885
US-20240368127-A1 HSD17B13 INHIBITORS AND USES THEREOF HSD17B3, HSD17B11, HSD17B1 KDM4E 3909/4885TYRO3 4802/4885DYRK1B 4005/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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