SCHEMBL26650429

SCHEMBL26650429

Cc1ccc2cc(N)nc(N3CCC(F)(F)CC3)c2n1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NOS3 P29474 3/20 0.41
NOS1 P29475 3/20 0.41
NOS2 P35228 3/20 0.41
SCN10A Q9Y5Y9 5/20 0.41
FFAR2 O15552 4/20 0.38
PIK3CA P42336 1/20 0.38
MTOR P42345 1/20 0.38
ADRB2 P07550 1/20 0.38
WHR1 P49842 3/20 0.36
MBOAT4 Q96T53 1/20 0.35
CCR1 P32246 1/20 0.33
RAB9A P51151 1/20 0.33
CCR5 P51681 1/20 0.33
CHRM3 P20309 1/20 0.33
PDE4A P27815 1/20 0.33
PDE4B Q07343 1/20 0.33
PDE4C Q08493 1/20 0.33
PDE4D Q08499 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
SCHEMBL26650968 0.84 NOS3 (0.36) NOS3NOS1NOS2SCN10AFFAR2
SCHEMBL30748646 0.84 NOS3 (0.36) NOS3NOS1NOS2SCN10AFFAR2
SCHEMBL26650584 0.84 NOS3 (0.36) NOS3NOS1NOS2SCN10AFFAR2
SCHEMBL26650701 0.83 SCN10A (0.41) NOS3NOS1NOS2SCN10AFFAR2
SCHEMBL26650487 0.78 GRM4 (0.43) NOS3NOS1NOS2SCN10AFFAR2
SCHEMBL26650616 0.78 ADRB2 (0.43) NOS3NOS1NOS2SCN10AFFAR2
SCHEMBL31373467 0.78 ADRB2 (0.43) NOS3NOS1NOS2SCN10AFFAR2
SCHEMBL24815653 0.74 NOS3 (0.45) NOS3NOS1NOS2SCN10AFFAR2
SCHEMBL22122604 0.74 PIK3CA (0.42) NOS3NOS1NOS2SCN10AFFAR2
SCHEMBL31485331 0.74 GSK3B (0.39) SCN10AWHR1

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