SCHEMBL29176142

SCHEMBL29176142

CC(C)=CCCc1cccc(PS)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 3/20 0.36
▸ PLA2G4A P47712 1/20 0.33
▸ CTSL P07711 1/20 0.33
▸ CNR2 P34972 2/20 0.32
▸ NOS1 P29475 1/20 0.31
▸ GGPS1 O95749 1/20 0.31
▸ PPARG P37231 3/20 0.31
▸ PPARA Q07869 2/20 0.31
▸ TRPA1 O75762 1/20 0.31
▸ INHA P05111 1/20 0.31
▸ CNR1 P21554 1/20 0.31
▸ SLC6A2 P23975 1/20 0.31
▸ HTR2A P28223 1/20 0.31
▸ SLC6A4 P31645 1/20 0.31
▸ OPRM1 P35372 1/20 0.31
▸ SLC6A3 Q01959 1/20 0.31
▸ KCNH2 Q12809 1/20 0.31
▸ TRPM8 Q7Z2W7 1/20 0.31
▸ TRPV3 Q8NET8 1/20 0.31
▸ TRPV4 Q9HBA0 1/20 0.31

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
SCHEMBL29176132 0.85 TRPV1 (0.37) TRPV1PLA2G4ACTSLCNR2NOS1
SCHEMBL27499784 0.76 DRD2 (0.53) OPRM1
SCHEMBL29176133 0.75 TRPV1 (0.35) TRPV1PLA2G4ACNR2NOS1GGPS1
SCHEMBL105976 0.73 TRPV1 (0.51) TRPV1
SCHEMBL11854025 0.71 TRPV1 (0.48) TRPV1CNR2GGPS1CNR1
SCHEMBL11854039 0.71 TRPV1 (0.48) TRPV1CNR2GGPS1CNR1
SCHEMBL3084716 0.69 PTPN1 (0.52) TRPV1CNR2GGPS1PPARGPPARA
SCHEMBL3084710 0.69 PTPN1 (0.52) TRPV1CNR2GGPS1PPARGPPARA
SCHEMBL12653031 0.69 CLK4 (0.41) —
SCHEMBL3090445 0.69 PTPN1 (0.52) TRPV1CNR2GGPS1PPARGPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113474388-B Method for converting phenyl isocyanate 陶氏环球技术有限责任公司 2024-03-22 — — CN disclosed
Send feedback