SCHEMBL7447238

SCHEMBL7447238

CSc1ccc(C(=O)CN2CCCCCC2=O)cc1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TNF P01375 1/20 0.48
KMT2A Q03164 3/20 0.46
MEN1 O00255 2/20 0.46
SMN1; SMN2 Q16637 3/20 0.42
RAB9A P51151 2/20 0.42
HTT P42858 2/20 0.42
MAPT P10636 2/20 0.42
TSHR P16473 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
ALDH1A1 P00352 2/20 0.41
HAO1 Q9UJM8 1/20 0.40
MITF O75030 1/20 0.39
HRH3 Q9Y5N1 1/20 0.39
MMP2 P08253 1/20 0.39
MMP9 P14780 1/20 0.39
MMP8 P22894 1/20 0.39
LMNA P02545 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
SCHEMBL8766644 0.89 HAO1 (0.43) TNFKMT2AMEN1SMN1; SMN2RAB9A
SCHEMBL5738593 0.82 SMN1; SMN2 (0.62) KMT2AMEN1SMN1; SMN2RAB9AHTT
SCHEMBL24634980 0.79 PKM (0.56) KMT2AMEN1SMN1; SMN2RAB9AHTT
SCHEMBL5739537 0.76 RAB9A (0.69) KMT2AMEN1SMN1; SMN2RAB9AHTT
SCHEMBL5739984 0.76 RAB9A (0.69) KMT2ASMN1; SMN2RAB9AHTTMAPT
SCHEMBL5738542 0.76 ALDH1A1 (0.54) KMT2AMEN1SMN1; SMN2RAB9AHTT
SCHEMBL10418997 0.75 HTT (0.63) KMT2AMEN1SMN1; SMN2RAB9AHTT
SCHEMBL12554864 0.71 TSHR (0.56) KMT2ASMN1; SMN2HTTTSHRL3MBTL1
SCHEMBL16563423 0.69 TRPV1 (0.48) SMN1; SMN2RAB9AHTTMAPTTSHR
SCHEMBL596327 0.69 TSHR (0.58) KMT2ASMN1; SMN2HTTTSHRL3MBTL1

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-1998005664-A1 6,7,8,9-TETRAHYDRO-5H-IMIDAZO[1,2-a]AZEPINE-3-ACETIC ACID DERIVATIVES, PREPARATION THEREOF AND THERAPEUTICAL USE THEREOF SYNTHELABO (FR) 1998-02-12 WO disclosed