SCHEMBL29965698

SCHEMBL29965698

COc1ccc(NC(=O)CCl)cc1F

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.53
MAP2K1 Q02750 1/20 0.53
MAPT P10636 3/20 0.51
KMT2A Q03164 2/20 0.51
KDM4E B2RXH2 1/20 0.51
MEN1 O00255 1/20 0.51
CYP1A2 P05177 1/20 0.50
CYP2C19 P33261 1/20 0.50
FFAR1 O14842 1/20 0.50
ENPP1 P22413 2/20 0.49
RAB9A P51151 2/20 0.49
TSHR P16473 1/20 0.49
GSTO1 P78417 1/20 0.49
NPC1 O15118 1/20 0.49
ALDH1A1 P00352 1/20 0.48
KCNQ3 O43525 1/20 0.48
KCNQ2 O43526 1/20 0.48

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
SCHEMBL20679600 1.00 SMN1; SMN2 (0.53) SMN1; SMN2MAP2K1MAPTKMT2AKDM4E
SCHEMBL27398825 0.88 GRM4 (0.58) SMN1; SMN2MAPTKMT2AKDM4EMEN1
SCHEMBL31051186 0.88 GRM4 (0.58) SMN1; SMN2MAPTKMT2AKDM4EMEN1
SCHEMBL22069579 0.87 ALDH1A1 (0.49) SMN1; SMN2MAPTKMT2AKDM4EMEN1
SCHEMBL22069737 0.86 FFAR1 (0.53) SMN1; SMN2MAPTKMT2AKDM4EMEN1
SCHEMBL8327094 0.86 TSHR (0.59) SMN1; SMN2MAP2K1KMT2ACYP1A2CYP2C19
SCHEMBL20679550 0.86 SMN1; SMN2 (0.66) SMN1; SMN2MAPTKMT2AKDM4EMEN1
SCHEMBL29663501 0.86 SMN1; SMN2 (0.66) SMN1; SMN2MAPTKMT2AKDM4EMEN1
SCHEMBL22069644 0.85 ALDH1A1 (0.47) SMN1; SMN2MAPTKMT2AKDM4EMEN1
SCHEMBL22069584 0.85 MAPT (0.50) SMN1; SMN2MAPTKMT2AKDM4EMEN1

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
EP-4313988-A1 PYRAZOLOPYRIMIDINONE COMPOUNDS Orphagen Pharmaceuticals, Inc. (US) 2024-02-07 EP disclosed
CN-117396480-A Pyrazolopyrimidinone compounds 奥弗恩制药公司 2024-01-12 CN disclosed
CN-111615388-B Immunotherapeutic agent for cancer 斯汀格瑞治疗股份有限公司 2023-11-14 CN disclosed
WO-2022204481-A1 PYRAZOLOPYRIMIDINONE COMPOUNDS Orphagen Pharmaceuticals, Inc. (US) 2022-09-29 WO disclosed