SCHEMBL629463

SCHEMBL629463

CN(C)c1ncc(Br)cn1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.48
HSD17B10 Q99714 4/20 0.48
KDM4E B2RXH2 3/20 0.48
ALOX15 P16050 1/20 0.48
GRM5 P41594 2/20 0.43
CYP1A2 P05177 4/20 0.38
LMNA P02545 1/20 0.38
THRB P10828 1/20 0.38
BLM P54132 1/20 0.38
CREBBP Q92793 1/20 0.38
KCNH2 Q12809 1/20 0.37
HPGD P15428 3/20 0.36
GBA1 P04062 1/20 0.35
CYP2D6 P10635 2/20 0.33
CASP1 P29466 2/20 0.33
CASP7 P55210 2/20 0.33
EGFR P00533 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
EDNRA P25101 1/20 0.33
DYRK1A Q13627 1/20 0.33

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
SCHEMBL9538524 0.76 GRM5 (0.40) ALDH1A1HSD17B10KDM4EALOX15GRM5
SCHEMBL17654205 0.75 GBA1 (0.44) ALDH1A1KDM4EGRM5GBA1SMN1; SMN2
SCHEMBL3129653 0.74 HSD17B10 (0.50) ALDH1A1HSD17B10KDM4EALOX15GRM5
SCHEMBL19276438 0.72 HSD17B10 (0.48) ALDH1A1HSD17B10KDM4EALOX15GRM5
SCHEMBL30775296 0.72 ALDH1A1 (0.48) ALDH1A1HSD17B10KDM4EALOX15GRM5
SCHEMBL29294865 0.72 HSD17B10 (0.48) ALDH1A1HSD17B10KDM4EALOX15GRM5
SCHEMBL13556548 0.72 HSD17B10 (0.48) ALDH1A1HSD17B10KDM4EALOX15GRM5
SCHEMBL3129639 0.72 HSD17B10 (0.48) ALDH1A1HSD17B10KDM4EALOX15GRM5
SCHEMBL4926690 0.72 HSD17B10 (0.54) ALDH1A1HSD17B10KDM4EALOX15GRM5
SCHEMBL5132886 0.72 ALDH1A1 (0.48) ALDH1A1HSD17B10KDM4EALOX15GRM5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117810541-A Nonaqueous magnesium electrolyte and preparation method thereof 青岛科技大学 2024-04-02 CN claimed
US-20250230169-A1 Phosphoinositide 3-Kinase Inhibitors with a Zinc Binding Moiety CURIS INC (US) 2025-07-17 US disclosed
EP-4061813-B1 PYRROLIDINE DERIVATIVES HOFFMANN LA ROCHE (CH) 2025-06-04 EP disclosed
EP-4551570-A1 NOVEL COMPOUNDS AS GCN2 INHIBITORS, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF Dong-A ST Co., Ltd. (KR) 2025-05-14 EP disclosed
EP-3589628-B1 ARYL, HETEROARYL, AND HETEROCYCLIC PHARMACEUTICAL COMPOUNDS FOR TREATMENT OF MEDICAL DISORDERS ACHILLION PHARMACEUTICALS INC (US) 2025-05-07 EP disclosed
US-12240836-B2 Compounds as GCN2 inhibitors, pharmaceutical compositions and uses thereof DONG-A ST CO., LTD. (KR) 2025-03-04 US disclosed
CN-117810541-B Nonaqueous magnesium electrolyte and preparation method thereof 青岛科技大学 2025-02-28 CN disclosed
CN-119403798-A Novel compounds as GCN2 inhibitors, pharmaceutical compositions and uses thereof 东亚ST 株式会社 2025-02-07 CN disclosed
US-12162860-B2 Aryl, heteroaryl, and heterocyclic pharmaceutical compounds for treatment of medical disorders ACHILLION PHARMACEUTICALS, INC. (US) 2024-12-10 US disclosed
US-12060347-B2 Bicyclic heteroaryl substituted compounds BRISTOL-MYERS SQUIBB COMPANY (US) 2024-08-13 US disclosed
EP-0821683-A1 BENZIMIDAZOLE COMPOUNDS AND THEIR USE AS MODULATORS OF THE GABA A? RECEPTOR COMPLEX NEUROSEARCH A/S (DK) 1998-02-04 EP disclosed
EP-0821684-A1 BENZIMIDAZOLE COMPOUNDS AND THEIR USE AS MODULATORS OF THE GABA A? RECEPTOR COMPLEX NEUROSEARCH A/S (DK) 1998-02-04 EP disclosed
WO-1996033194-A1 BENZIMIDAZOLE COMPOUNDS AND THEIR USE AS MODULATORS OF THE GABA A RECEPTOR COMPLEX NEUROSEARCH A/S (DK) 1996-10-24 WO disclosed
WO-1996033192-A1 BENZIMIDAZOLE COMPOUNDS AND THEIR USE AS MODULATORS OF THE GABAA RECEPTOR COMPLEX NEUROSEARCH A/S (DK) 1996-10-24 WO disclosed
US-5304647-A Addition of an organolithium reagent; dehydrogenation of addition product; two-phase conditions prevents hydrolysis GEORGIA STATE UNIVERSITY FOUNDATION, INC. (US) 1994-04-19 US disclosed
EP-0544705-A1 DERIVATIVES OF MUPIROCIN Beecham Group p.l.c. (GB) 1993-06-09 EP disclosed
WO-1992002518-A1 DERIVATIVES OF MUPIROCIN BEECHAM GROUP PLC (GB) 1992-02-20 WO disclosed
US-4963676-A INTERMEDIATES FOR NOVEL UNFUSED HETEROBICYCLIC COMPOUNDS WITH BIOLOGICAL ACTIVITY; ANTICANCER AGENTS GEORGIA STATE UNIVERSITY FOUNDATION, INC. (US) 1990-10-16 US disclosed
US-4929726-A ANTICARCINOGENIC AGENTS GEORGIA STATE UNIVERSITY FOUNDATION, INC. (US) 1990-05-29 US disclosed
WO-1989007599-A2 NOVEL DIAZINES AND THEIR METHOD OF PREPARATION GEORGIA STATE UNIVERSITY FOUNDATION, INC. (US) 1989-08-24 WO 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 (4 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-12060347-B2 Bicyclic heteroaryl substituted compounds F2, F2RL3, F12 ALDH1A1 1598/4885HSD17B10 2146/4885KDM4E 2420/4885
US-20250230169-A1 Phosphoinositide 3-Kinase Inhibitors with a Zinc Binding Moiety BAZ2A, BAZ2B, PI4KB ALDH1A1 3415/4885HSD17B10 3321/4885KDM4E 868/4885
US-12240836-B2 Compounds as GCN2 inhibitors, pharmaceutical compositions and uses thereof EIF2AK4, GCN1, GCGR ALDH1A1 3927/4885HSD17B10 289/4885KDM4E 4591/4885
US-12162860-B2 Aryl, heteroaryl, and heterocyclic pharmaceutical compounds for treatment of medical disorders CFD, TFPI, CFH ALDH1A1 2338/4885HSD17B10 1063/4885KDM4E 3553/4885

“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.