SCHEMBL30786272

SCHEMBL30786272

COc1ccc(CSc2c(F)cccc2C(=O)NC2CC2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 1/20 0.49
TAS1R3 Q7RTX0 1/20 0.46
TAS1R1 Q7RTX1 1/20 0.46
TAS1R2 Q8TE23 1/20 0.46
CCNE1 P24864 1/20 0.45
CDK2 P24941 1/20 0.45
CNR1 P21554 3/20 0.45
CNR2 P34972 3/20 0.45
DRD3 P35462 1/20 0.45
KLK7 P49862 1/20 0.44
GAA P10253 1/20 0.44
EPHX2 P34913 1/20 0.44
FAAH O00519 1/20 0.43
ABHD6 Q9BV23 1/20 0.43
ALDH1A1 P00352 1/20 0.43
POLB P06746 2/20 0.43
LMNA P02545 1/20 0.43
RXFP1 Q9HBX9 1/20 0.43
CCR3 P51677 2/20 0.43
KDM4E B2RXH2 1/20 0.43

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
SCHEMBL17080240 0.83 KDM4E (0.46) ALDH1A1POLBLMNAKDM4ENPSR1
SCHEMBL30786136 0.83 KDM4E (0.46) ALDH1A1POLBLMNAKDM4ENPSR1
SCHEMBL30786121 0.81 TP53 (0.50) GAAALDH1A1POLBKDM4ENPSR1
SCHEMBL30786123 0.81 TP53 (0.50) GAAALDH1A1POLBKDM4ENPSR1
SCHEMBL8208193 0.71 MEN1 (0.47) ALDH1A1POLBLMNANPSR1MAPT
SCHEMBL2469758 0.71 HPGD (0.51) CNR1CNR2KLK7ALDH1A1POLB
SCHEMBL3172457 0.69 TAS1R3 (0.59) TAS1R3TAS1R1TAS1R2GAAALDH1A1
SCHEMBL24898064 0.69 MAOB (0.43) ALDH1A1POLBLMNAMAPT
SCHEMBL30786194 0.69 MEN1 (0.44) ALDH1A1LMNAKDM4EMAPT
SCHEMBL17080275 0.69 MEN1 (0.44) ALDH1A1LMNAKDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025082316-A1 OPHTHALMIC FORMATION, AND PREPARATION METHOD THEREFOR AND USE THEREOF 苏州必扬医药科技有限公司 2025-04-24 WO disclosed
CN-119604488-A Protein tyrosine kinase inhibitor and medical application thereof 苏州必扬医药科技有限公司 2025-03-11 CN disclosed
WO-2024032584-A1 PROTEIN TYROSINE KINASE INHIBITOR AND MEDICAL USE THEREOF 苏州必扬医药科技有限公司 2024-02-15 WO disclosed