SCHEMBL10042832

SCHEMBL10042832

CC1c2cccc(c2)C2NC(=O)C(c3ccccc3)NC(=O)C(NC2=O)c2cccc1c2

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.40
ADORA3 P0DMS8 1/20 0.40
MAPT P10636 4/20 0.38
ALDH1A1 P00352 3/20 0.38
HPGD P15428 2/20 0.38
GAA P10253 2/20 0.38
KDM4E B2RXH2 1/20 0.38
GFER P55789 1/20 0.38
KMT2A Q03164 1/20 0.38
HSD17B10 Q99714 1/20 0.38
USP2 O75604 1/20 0.37
MAPK10 P53779 1/20 0.37
CA2 P00918 1/20 0.37
TSHR P16473 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
SLC6A3 Q01959 1/20 0.36
BRD4 O60885 3/20 0.35
DDB1 Q16531 1/20 0.35
CRBN Q96SW2 1/20 0.35

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
SCHEMBL1894049 0.82 MAPT (0.48) LMNAADORA3MAPTALDH1A1HPGD
SCHEMBL15669931 0.82 MAPT (0.48) LMNAADORA3MAPTALDH1A1HPGD
SCHEMBL1895535 0.82 MAPT (0.48) LMNAADORA3MAPTALDH1A1HPGD
Methane SCHEMBL11336749 0.78 MAPT (0.48) LMNAADORA3MAPTALDH1A1HPGD
SCHEMBL10541313 0.76 TNKS2 (0.46) LMNAADORA3MAPTALDH1A1HPGD
Naphthalene SCHEMBL28102989 0.74 MAPT (0.46) LMNAADORA3MAPTALDH1A1HPGD
SCHEMBL24164732 0.72 CRBN (0.54) LMNAALDH1A1CA2BRD4DDB1
SCHEMBL10540567 0.72 SLC6A3 (0.56) MAPTALDH1A1HPGDGAAKMT2A
SCHEMBL12570222 0.71 HTR6 (0.37) MAPTALDH1A1HPGDGAAHSD17B10
Ammonia Solution, Strong SCHEMBL3794256 0.71

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
US-20120074336-A1 LIGHT-DRIVEN ROTARY MOLECULAR MOTORS BOARD OF REGENTS OF THE NEVADA SYSTEM OF HIGHER EDUCATION, ON BEHALF OF THE (US) 2012-03-29 US disclosed