SCHEMBL30989956

SCHEMBL30989956

COc1ncc(Cl)cc1C(=O)NC1CCOc2ccccc21

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 11/20 0.54
▸ BRD4 O60885 2/20 0.44
▸ CREBBP Q92793 2/20 0.44
▸ TRPV1 Q8NER1 1/20 0.43
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ HTR2A P28223 1/20 0.40
▸ HPGDS O60760 1/20 0.39
▸ P2RX7 Q99572 1/20 0.39

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
SCHEMBL30989885 0.90 MAPK1 (0.43) MAPK1HTR2AP2RX7
SCHEMBL30989892 0.88 NTRK1 (0.46) MAPK1TRPV1P2RX7
SCHEMBL30989929 0.85 P2RX7 (0.42) MAPK1TRPV1MEN1KMT2AP2RX7
SCHEMBL30989933 0.85 P2RX7 (0.42) MAPK1TRPV1MEN1KMT2AP2RX7
SCHEMBL30990021 0.83 TAS1R3 (0.57) MEN1KMT2AHPGDS
SCHEMBL30989941 0.80 MAPK1 (0.43) MAPK1
SCHEMBL30990023 0.80 MAPK1 (0.43) MAPK1
SCHEMBL21875803 0.79 MAPK1 (0.42) MAPK1BRD4CREBBPTRPV1KMT2A
SCHEMBL29438346 0.79 MAPK1 (0.42) MAPK1BRD4CREBBPTRPV1KMT2A
SCHEMBL29965218 0.79 MAPK1 (0.42) MAPK1BRD4CREBBPTRPV1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4612131-A1 NICOTINAMIDE DERIVATIVES FOR USE IN TREATING DISORDERS ASSOCIATED WITH KCNK13 ACTIVITY Cerevance, Inc. (US) 2025-09-10 — — EP disclosed
WO-2024095003-A1 NICOTINAMIDE DERIVATIVES FOR USE IN TREATING DISORDERS ASSOCIATED WITH KCNK13 ACTIVITY Cerevance, Inc. (US) 2024-05-10 — — WO disclosed
Send feedback