SCHEMBL4742414

SCHEMBL4742414

C[CH]c1oc2ccccc2c1C

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.53
KDM4E B2RXH2 2/20 0.43
SMN1; SMN2 Q16637 3/20 0.40
MAOA P21397 3/20 0.40
ALDH1A1 P00352 2/20 0.40
HPGD P15428 2/20 0.40
HSD17B10 Q99714 2/20 0.40
GLA P06280 1/20 0.40
CYP3A4 P08684 1/20 0.40
MAPT P10636 1/20 0.40
PGAM1 P18669 1/20 0.40
CASP1 P29466 1/20 0.40
CASP7 P55210 1/20 0.40
KCNH2 Q12809 1/20 0.39
HTT P42858 2/20 0.38
RECQL P46063 2/20 0.38
TSHR P16473 1/20 0.38
AKR1B1 P15121 1/20 0.38
KMT2A Q03164 2/20 0.37
CHRM2 P08172 1/20 0.37

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
SCHEMBL19546812 0.84 L3MBTL1 (0.58) L3MBTL1KDM4ESMN1; SMN2MAOAALDH1A1
SCHEMBL18892996 0.82 L3MBTL1 (0.51) L3MBTL1KDM4ESMN1; SMN2MAOAALDH1A1
SCHEMBL719219 0.82 L3MBTL1 (0.55) L3MBTL1KDM4ESMN1; SMN2MAOAALDH1A1
SCHEMBL23430325 0.79 L3MBTL1 (0.53) L3MBTL1KDM4ESMN1; SMN2MAOAALDH1A1
SCHEMBL28812099 0.77 L3MBTL1 (0.51) L3MBTL1KDM4ESMN1; SMN2MAOAALDH1A1
SCHEMBL4092983 0.76 L3MBTL1 (0.57) L3MBTL1KDM4ESMN1; SMN2ALDH1A1HPGD
SCHEMBL21913545 0.76 L3MBTL1 (0.54) L3MBTL1KDM4ESMN1; SMN2MAOAALDH1A1
SCHEMBL20019274 0.76 L3MBTL1 (0.54) L3MBTL1KDM4ESMN1; SMN2MAOAALDH1A1
SCHEMBL16648249 0.76 L3MBTL1 (0.50) L3MBTL1KDM4ESMN1; SMN2MAOAALDH1A1
SCHEMBL4794783 0.75 L3MBTL1 (0.52) L3MBTL1KDM4ESMN1; SMN2ALDH1A1HPGD

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-2008104756-A1 UREA DERIVATIVES AND THEIR THERAPEUTIC USE SERENTIS LIMITED (GB) 2008-09-04 WO disclosed