SCHEMBL7424345

SCHEMBL7424345

CC(=O)N1CCc2cc(NCC(Cl)=CC(=O)C(F)(F)F)ccc21

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 5/20 0.50
MAPT P10636 4/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
NPC1 O15118 1/20 0.47
TP53 P04637 1/20 0.47
RAB9A P51151 1/20 0.47
TRIM24 O15164 4/20 0.44
LMNA P02545 4/20 0.44
POLB P06746 3/20 0.43
RXFP1 Q9HBX9 1/20 0.43
HPGD P15428 1/20 0.43
USP2 O75604 1/20 0.43
GAA P10253 1/20 0.43
PKM P14618 1/20 0.43
TSHR P16473 1/20 0.43
HTT P42858 1/20 0.43

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
SCHEMBL7419833 0.86 NOTUM (0.54) NOTUMMAPTSMN1; SMN2NPC1TP53
SCHEMBL7418643 0.80 NOTUM (0.56) NOTUMMAPTSMN1; SMN2NPC1TP53
SCHEMBL5781313 0.78 NOTUM (0.57) NOTUMMAPTSMN1; SMN2NPC1TP53
SCHEMBL1948510 0.73 NOTUM (0.64) NOTUMMAPTSMN1; SMN2NPC1TP53
SCHEMBL13002857 0.71 NOTUM (0.65) NOTUMMAPTSMN1; SMN2NPC1TP53
SCHEMBL14148139 0.71 NOTUM (0.60) NOTUMMAPTSMN1; SMN2NPC1TP53
SCHEMBL4240300 0.71 TRIM24 (0.60) NOTUMMAPTSMN1; SMN2NPC1TP53
SCHEMBL11682254 0.70 SMN1; SMN2 (0.70) NOTUMMAPTSMN1; SMN2NPC1TP53
SCHEMBL3767593 0.69 SMN1; SMN2 (0.72) NOTUMMAPTSMN1; SMN2NPC1TP53
SCHEMBL7413801 0.69 LMNA (0.57) NOTUMMAPTSMN1; SMN2NPC1TP53

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
WO-1994004533-A1 CONDENSED INDOLE DERIVATIVES AS 5HT2C AND 5HT2B ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 1994-03-03 WO disclosed