SCHEMBL8588694

SCHEMBL8588694

CCn1ncc(C(=O)c2cc(C)c3c(c2C)NC(=O)C=CS3)c1O

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
LMNA P02545 1/20 0.32
ALDH1A1 P00352 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C19 P33261 1/20 0.32

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
SCHEMBL6728833 0.73 RAB9A (0.35) RAB9ASMN1; SMN2LMNAALDH1A1CYP1A2
SCHEMBL8123433 0.72 RAB9A (0.33) RAB9ASMN1; SMN2LMNAALDH1A1CYP1A2
SCHEMBL6721329 0.72 LMNA (0.34) RAB9ASMN1; SMN2LMNAALDH1A1CYP1A2
SCHEMBL27524777 0.71 LMNA (0.44) RAB9ASMN1; SMN2LMNAALDH1A1CYP1A2
SCHEMBL8892726 0.71 ALDH1A1 (0.35) RAB9ASMN1; SMN2LMNAALDH1A1CYP1A2
SCHEMBL8895824 0.71 SMN1; SMN2 (0.33) RAB9ASMN1; SMN2LMNAALDH1A1CYP1A2
SCHEMBL8455943 0.69 RAB9A (0.32) RAB9ASMN1; SMN2LMNAALDH1A1CYP1A2
SCHEMBL8509129 0.67 DRD2 (0.42) RAB9ASMN1; SMN2LMNAALDH1A1CYP1A2
SCHEMBL8940911 0.67 RAB9A (0.31) RAB9ASMN1; SMN2LMNAALDH1A1CYP1A2
SCHEMBL8941039 0.67 PDE4B (0.32) RAB9ASMN1; SMN2LMNAALDH1A1CYP1A2

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
JP-10130267-A None JP disclosed
JP-H10130267-A PYRAZOLE DERIVATIVE AND HERBICIDE USING THE SAME IDEMITSU KOSAN CO LTD 1998-05-19 JP disclosed