SCHEMBL1285336

SCHEMBL1285336

c1cnc2nncnc2c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
KDM4E B2RXH2 2/20 0.36
MAPT P10636 2/20 0.36
BCHE P06276 3/20 0.34
ACHE P22303 3/20 0.34
EGFR P00533 2/20 0.32
MAPK14 Q16539 1/20 0.32
NUDT1 P36639 1/20 0.31
GMNN O75496 1/20 0.31
LMNA P02545 1/20 0.31
TP53 P04637 1/20 0.31
HSP90AA1 P07900 1/20 0.31
MMP2 P08253 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
MMP9 P14780 1/20 0.31
ALOX15 P16050 1/20 0.31
TSHR P16473 1/20 0.31
NFKB1 P19838 1/20 0.31
MMP8 P22894 1/20 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
SCHEMBL4937147 0.82 ALDH1A1 (0.39) ALDH1A1KDM4EMAPTBCHEACHE
SCHEMBL16878159 0.76
SCHEMBL29358342 0.72 ALDH1A1 (0.55) ALDH1A1KDM4EMAPTBCHEACHE
SCHEMBL29408294 0.72 ALDH1A1 (0.55) ALDH1A1KDM4EMAPTBCHEACHE
SCHEMBL88611 0.72 ALDH1A1 (0.55) ALDH1A1KDM4EMAPTBCHEACHE
SCHEMBL17511866 0.71 ALDH1A1 (0.42) ALDH1A1KDM4EMAPTBCHEACHE
SCHEMBL88615 0.70 EGFR (0.41) ALDH1A1KDM4EMAPTACHEEGFR
SCHEMBL29599774 0.70 EGFR (0.41) ALDH1A1KDM4EMAPTACHEEGFR
SCHEMBL16878626 0.70
SCHEMBL162418 0.69 MAPK1 (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4320127-A Pyrido[3,2-e]-as-triazines EDYT GYOGYSZERVEGYESZETI GYAR (HU) 1982-03-16 US claimed
US-20250250282-A1 NOVEL SEVEN-MEMBERED RING-FUSED COMPOUNDS Prism BioLab Co., Ltd. (JP) 2025-08-07 US disclosed
EP-4508052-A1 NOVEL SEVEN-MEMBERED RING-FUSED COMPOUNDS PRISM BioLab Co., Ltd. (JP) 2025-02-19 EP disclosed
US-20240309006-A1 NOVEL BICYCLIC COMPOUNDS Prism BioLab Co., Ltd. (JP) 2024-09-19 US disclosed
EP-4281456-A1 NOVEL BICYCLIC COMPOUNDS PRISM BioLab Co., Ltd. (JP) 2023-11-29 EP disclosed
US-20230374034-A1 NOVEL BICYCLIC COMPOUNDS Prism BioLab Co., Ltd. (JP) 2023-11-23 US disclosed
WO-2023200017-A1 NOVEL SEVEN-MEMBERED RING-FUSED COMPOUNDS Prism BioLab Co., Ltd. (JP) 2023-10-19 WO disclosed
US-20230265104-A1 NOVEL HETEROCYCLIC COMPOUNDS Prism BioLab Co., Ltd. (JP) 2023-08-24 US disclosed
EP-4225760-A1 NOVEL BICYCLIC COMPOUNDS PRISM BioLab Co., Ltd. (JP) 2023-08-16 EP disclosed
EP-4219463-A1 TERPYRIDINE DIKETONE COMPOUND OR SALT THEREOF, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF Shenzhen Salubris Pharmaceuticals Co., Ltd. (CN) 2023-08-02 EP disclosed
US-20110092459-A1 ALPHA HELIX MIMETICS AND METHODS RELATING THERETO PRISM BIOLAB CORPORATION (JP) 2011-04-21 US disclosed
US-20080318962-A1 Fungicides Based on Nitrogen-Containing Heterocycles SYNGENTA CROP PROTECTION, INC. (US) 2008-12-25 US disclosed
EP-1771423-A1 FUNGICIDES BASED ON NITROGEN-CONTAINING HETEROCYCLES Syngeta Participations AG (CH) 2007-04-11 EP disclosed
EP-1575956-B1 FUNGICIDES BASED ON NITROGEN-CONTAINING HETEROCYCLES SYNGENTA LTD (GB) 2007-03-28 EP disclosed
US-20060100203-A1 Fungicides based on nitrogen-containing heterocycles SYNGENTA CROP PROTECTION, INC. 2006-05-11 US disclosed
WO-2005123698-A1 FUNGICIDES BASED ON NITROGEN-CONTAINING HETEROCYCLES SYNGENTA PARTICIPATIONS AG (CH) 2005-12-29 WO disclosed
EP-1575956-A1 FUNGICIDES BASED ON NITROGEN-CONTAINING HETEROCYCLES Syngenta Limited (GB) 2005-09-21 EP disclosed
WO-2004056829-A1 FUNGICIDES BASED ON NITROGEN-CONTAINING HETEROCYCLES SYNGENTA LIMITED (GB) 2004-07-08 WO disclosed
US-4320127-A Pyrido[3,2-e]-as-triazines EDYT GYOGYSZERVEGYESZETI GYAR (HU) 1982-03-16 US disclosed
US-4320127-A Pyrido[3,2-e]-as-triazines EDYT GYOGYSZERVEGYESZETI GYAR (HU) 1982-03-16 US 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 (7 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-20230374034-A1 NOVEL BICYCLIC COMPOUNDS NOTCH1, NOTCH2, HES1 ALDH1A1 1622/4885KDM4E 1654/4885MAPT 3076/4885
US-20060100203-A1 Fungicides based on nitrogen-containing heterocycles TACR3, NTSR1, CHRM1 ALDH1A1 3737/4885KDM4E 1688/4885MAPT 4379/4885
US-20230265104-A1 NOVEL HETEROCYCLIC COMPOUNDS MKI67, CCNI, KRAS ALDH1A1 345/4885KDM4E 1517/4885MAPT 4332/4885
US-20080318962-A1 Fungicides Based on Nitrogen-Containing Heterocycles DDT, CYP4X1, CBR1 ALDH1A1 2559/4885KDM4E 471/4885MAPT 4342/4885
US-20240309006-A1 NOVEL BICYCLIC COMPOUNDS NOTCH1, NOTCH2, HES1 ALDH1A1 1423/4885KDM4E 1617/4885MAPT 3119/4885
US-20250250282-A1 NOVEL SEVEN-MEMBERED RING-FUSED COMPOUNDS NOTCH1, NOTCH2, NOTCH4 ALDH1A1 2685/4885KDM4E 2182/4885MAPT 2864/4885
US-20110092459-A1 ALPHA HELIX MIMETICS AND METHODS RELATING THERETO COL1A1, PLOD3, THPO ALDH1A1 1615/4885KDM4E 3931/4885MAPT 1429/4885

“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.