SCHEMBL26650487

SCHEMBL26650487

Nc1cc2cccnc2c(N2CCC(F)(F)CC2)n1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GRM4 Q14833 3/20 0.43
HRH4 Q9H3N8 1/20 0.41
SCN10A Q9Y5Y9 1/20 0.40
PDE10A Q9Y233 1/20 0.39
PIK3CD O00329 4/20 0.37
PIK3CA P42336 4/20 0.37
PIK3CG P48736 3/20 0.37
MTOR P42345 3/20 0.37
FFAR2 O15552 3/20 0.37
KRAS P01116 1/20 0.37
NOS3 P29474 1/20 0.36
NOS1 P29475 1/20 0.36
NOS2 P35228 1/20 0.36
PRMT5 O14744 1/20 0.36
PDE4D Q08499 1/20 0.36

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
SCHEMBL30600701 0.81 GRM4 (0.52) GRM4HRH4SCN10APDE10AMTOR
SCHEMBL9686406 0.81 PIK3CD (0.55) PIK3CDPIK3CAPIK3CGMTORPDE4D
SCHEMBL26646371 0.78 SCN10A (0.46) GRM4SCN10A
SCHEMBL31316098 0.78 SLC6A4 (0.43) GRM4SCN10AFFAR2
SCHEMBL26650968 0.78 NOS3 (0.36) GRM4SCN10APDE10APIK3CAMTOR
SCHEMBL26650584 0.78 NOS3 (0.36) GRM4SCN10APDE10APIK3CAMTOR
SCHEMBL30748646 0.78 NOS3 (0.36) GRM4SCN10APDE10APIK3CAMTOR
SCHEMBL26646217 0.78 SLC6A4 (0.43) GRM4SCN10AFFAR2
SCHEMBL26650429 0.78 NOS3 (0.41) SCN10APIK3CAMTORFFAR2NOS3
SCHEMBL30748575 0.78 GRM4 (0.42) GRM4HRH4SCN10APDE10AMTOR

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
EP-4524135-A1 KINESIN KIF18A INHIBITOR AND USE THEREOF Shanghai Apeiron Therapeutics Company Limited (CN) 2025-03-19 EP disclosed
CN-119212988-A Kinesin KIF18A inhibitor and application thereof 上海湃隆生物科技有限公司 2024-12-27 CN disclosed
WO-2023217230-A1 KINESIN KIF18A INHIBITOR AND USE THEREOF 上海湃隆生物科技有限公司 2023-11-16 WO disclosed