SCHEMBL29536669

SCHEMBL29536669

CSc1ncc2cc(Br)c(NCCO)nc2n1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ AKT1 P31749 13/20 0.39
▸ AKT2 P31751 13/20 0.39
▸ ALDH1A1 P00352 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ LMNA P02545 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ CYP1A2 P05177 1/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ CYP2D6 P10635 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ EGFR P00533 1/20 0.33
▸ CCNA2 P20248 1/20 0.33
▸ CDK2 P24941 1/20 0.33
▸ CCNA1 P78396 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
SCHEMBL25227024 1.00 AKT1 (0.39) AKT1AKT2ALDH1A1POLBLMNA
SCHEMBL25271560 0.94 AKT1 (0.39) AKT1AKT2ALDH1A1CYP1A2CYP3A4
SCHEMBL29536658 0.94 AKT1 (0.39) AKT1AKT2ALDH1A1CYP1A2CYP3A4
SCHEMBL25278070 0.88 CYP1A2 (0.40) AKT1AKT2ALDH1A1MAPTCYP1A2
SCHEMBL25271264 0.82 AKT1 (0.34) AKT1AKT2ALDH1A1MAPTHTT
SCHEMBL29537498 0.82 AKT1 (0.34) AKT1AKT2ALDH1A1MAPTHTT
SCHEMBL27103103 0.80 FLT3 (0.39) ALDH1A1POLBLMNAMAPTEGFR
SCHEMBL25227902 0.80 CDK1 (0.39) AKT1AKT2CDK2
SCHEMBL24271449 0.80 AKT1 (0.34) AKT1AKT2CYP3A4CYP2D6CDK2
SCHEMBL25227955 0.80 CDK1 (0.39) AKT1AKT2CDK2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025043350-A1 TRIAZOLOPYRIDOPYRIMIDINE AND DIHYDROIMIDAZOPYRIDOPYRIMIDINE DERIVATIVES AS INHIBITORS OF THE GCN2 KINASE, COMPOSITIONS AND USES THEREOF ONTARIO INSTITUTE FOR CANCER RESEARCH (OICR) (CA) 2025-03-06 — — WO disclosed
CN-116710453-A Kinase inhibitors and uses thereof 璧辰医药技术股份有限公司 2023-09-05 — — CN disclosed
EP-4192582-A1 KINASE INHIBITORS AND USES THEREOF ABM Therapeutics Corporation (US) 2023-06-14 — — EP disclosed
WO-2022032071-A1 KINASE INHIBITORS AND USES THEREOF ABM THERAPEUTICS CORPORATION (US) 2022-02-10 — — WO disclosed
Send feedback