SCHEMBL9474642

SCHEMBL9474642

CC(=O)c1ccc(-c2ccc(Cc3ccccc3)cc2)cc1

nearest known ligand 0.89

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.89
KMT2A Q03164 2/20 0.73
MAPT P10636 3/20 0.70
SMN1; SMN2 Q16637 3/20 0.70
PLA2G10 O15496 1/20 0.58
PLA2G2A P14555 1/20 0.58
MAOB P27338 1/20 0.54
HSD17B1 P14061 1/20 0.53
MMP12 P39900 1/20 0.51
MMP13 P45452 1/20 0.51
HPGD P15428 2/20 0.49
ALDH1A1 P00352 2/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
HTT P42858 1/20 0.49
CA12 O43570 2/20 0.49
CA1 P00915 2/20 0.49
CA2 P00918 2/20 0.49
CA9 Q16790 2/20 0.49
CA14 Q9ULX7 2/20 0.49
SRD5A2 P31213 1/20 0.49

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
SCHEMBL9474883 0.96 LMNA (0.81) LMNAKMT2AMAPTSMN1; SMN2PLA2G10
SCHEMBL2772794 0.94 LMNA (1.00) LMNAKMT2AMAPTSMN1; SMN2PLA2G10
SCHEMBL7741913 0.89 MAPT (0.70) LMNAKMT2AMAPTSMN1; SMN2MAOB
SCHEMBL6859304 0.85 KMT2A (1.00) LMNAKMT2AMAPTSMN1; SMN2PLA2G10
SCHEMBL7252924 0.83 MAPT (1.00) LMNAMAPTSMN1; SMN2HSD17B1HPGD
SCHEMBL51207 0.83 MAPT (1.00) LMNAMAPTSMN1; SMN2HSD17B1HPGD
SCHEMBL7738989 0.83 MAPT (1.00) LMNAMAPTSMN1; SMN2HSD17B1HPGD
SCHEMBL28036036 0.82 LMNA (0.78) LMNAKMT2AMAPTSMN1; SMN2PLA2G10
SCHEMBL2354530 0.82 LMNA (0.77) LMNAKMT2AMAPTSMN1; SMN2MAOB
SCHEMBL16864582 0.82 KMT2A (0.83) LMNAKMT2AMAPTSMN1; SMN2PLA2G10

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-5112504-A None JP disclosed
JP-H05112504-A BUTADIENE DERIVATIVE AND ELECTROPHOTOGRAPHIC PHOTORECEPTOR USING THE SAME MITA IND CO LTD 1993-05-07 JP disclosed