SCHEMBL7447378

SCHEMBL7447378

CCCNc1[c]cccc1F

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 2/20 0.36
CYP1A2 P05177 1/20 0.34
DRD2 P14416 1/20 0.32
DRD3 P35462 1/20 0.32
IDO1 P14902 1/20 0.32
TAAR1 Q96RJ0 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.31
HDAC3 O15379 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC2 Q92769 1/20 0.31
MAPK14 Q16539 2/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
PSIP1 O75475 1/20 0.30

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
SCHEMBL4600275 0.85 TRPA1 (0.33) TRPA1PSIP1
SCHEMBL6642136 0.82 CHEK1 (0.39) IDO1MEN1KMT2A
SCHEMBL6634986 0.81 TAAR1 (0.40) TAAR1MEN1KMT2A
SCHEMBL6639584 0.78 NPC1 (0.40) DRD3TAAR1KMT2A
SCHEMBL4600157 0.74
SCHEMBL4598872 0.73 RAB9A (0.35) SMN1; SMN2MEN1KMT2A
SCHEMBL4598888 0.73 POLB (0.39) IDO1SMN1; SMN2HDAC1KMT2A
SCHEMBL6637171 0.73 KDM4E (0.30) CYP1A2DRD3
SCHEMBL6634388 0.70 RAD52 (0.45) MEN1KMT2A
SCHEMBL19121210 0.70 TRPA1 (0.44) TRPA1CYP1A2DRD2DRD3IDO1

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
CN-109414019-B Plant growth regulator compounds 先正达参股股份有限公司 2021-04-30 CN disclosed
EP-1165557-A1 ARYL AND HETEROARYL FUSED AMINOALKYL-IMIDAZOLE DERIVATIVES: SELECTIVE MODULATORS OF GABAa RECEPTORS NEUROGEN CORPORATION (US) 2002-01-02 EP disclosed
WO-2000059905-A1 ARYL AND HETEROARYL FUSED AMINOALKYL-IMIDAZOLE DERIVATIVES: SELECTIVE MODULATORS OF GABAa RECEPTORS NEUROGEN CORPORATION (US) 2000-10-12 WO disclosed