SCHEMBL6295636

SCHEMBL6295636

CO/C(=C/C=C/c1cc2cc(Cl)c(Cl)cc2[nH]1)C(=O)NC1CCCC(N(C)C)C1

nearest known ligand 0.70

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ATP6V1B1 P15313 5/20 0.70
ATP6AP1 Q15904 1/20 0.59
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 2/20 0.33
HPGD P15428 2/20 0.33
NPSR1 Q6W5P4 2/20 0.33
GAA P10253 1/20 0.33
TSHR P16473 1/20 0.33
HSD17B10 Q99714 1/20 0.33
USP2 O75604 1/20 0.32
ALOX15 P16050 1/20 0.32
MDM2 Q00987 1/20 0.30

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
SCHEMBL6295637 1.00 ATP6V1B1 (0.70) ATP6V1B1ATP6AP1KDM4EALDH1A1HPGD
SCHEMBL6295634 1.00 ATP6V1B1 (0.70) ATP6V1B1ATP6AP1KDM4EALDH1A1HPGD
SCHEMBL6292583 0.85 ATP6V1B1 (0.93) ATP6V1B1ATP6AP1
SCHEMBL6295583 0.83 ATP6V1B1 (1.00) ATP6V1B1ATP6AP1GAATSHRHSD17B10
SCHEMBL6295582 0.83 ATP6V1B1 (1.00) ATP6V1B1ATP6AP1GAATSHRHSD17B10
SCHEMBL6291701 0.81 ATP6V1B1 (0.81) ATP6V1B1ATP6AP1
SCHEMBL6291700 0.81 ATP6V1B1 (0.81) ATP6V1B1ATP6AP1
SCHEMBL6291696 0.81 ATP6V1B1 (0.81) ATP6V1B1ATP6AP1
SCHEMBL6374814 0.79 ATP6V1B1 (0.74) ATP6V1B1ATP6AP1
SCHEMBL6295623 0.79 ATP6V1B1 (0.82) ATP6V1B1ATP6AP1TSHR

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-6903117-B2 Indole derivatives for the treatment of osteoporosis NIKEM RESEARCH S.R.L. (IT) 2005-06-07 US disclosed