SCHEMBL9509983

SCHEMBL9509983

CN(C)CCC(=O)c1ccc(C(=O)CCN(C)C)cc1

nearest known ligand 0.72

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GSR P00390 2/20 0.72
THRA P10827 13/20 0.64
THRB P10828 10/20 0.64
KMT2A Q03164 1/20 0.61
EGFR P00533 2/20 0.60
HSD17B3 P37058 1/20 0.48

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
Hydrochloric Acid SCHEMBL10353476 0.98 GSR (0.73) GSRTHRATHRBKMT2AEGFR
SCHEMBL11270329 0.92 GSR (0.64) GSRTHRATHRBEGFRHSD17B3
SCHEMBL5458640 0.92 GSR (0.64) GSRTHRATHRBKMT2AEGFR
SCHEMBL13917786 0.90 GSR (0.62) GSRTHRATHRBKMT2AEGFR
Hydrochloric Acid SCHEMBL3327743 0.90 GSR (0.65) GSRTHRATHRBEGFRHSD17B3
SCHEMBL1776744 0.90 GSR (0.62) GSRTHRATHRBKMT2AEGFR
SCHEMBL3989592 0.90 GSR (0.62) GSRTHRATHRBKMT2AEGFR
Hydrochloric Acid SCHEMBL5954533 0.90 GSR (0.65) GSRTHRATHRBKMT2AEGFR
SCHEMBL29965045 0.90 GSR (0.62) GSRTHRATHRBKMT2AEGFR
SCHEMBL4734470 0.90 GSR (0.62) GSRTHRATHRBKMT2AEGFR

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-1315416-A None JP disclosed
EP-0260877-B1 Photosensitizers and polymerizable compositions MINNESOTA MINING & MFG (US) 1993-11-03 EP disclosed
JP-H01315416-A CONDUCTIVE HETEROCYCLIC POLYMER AND ITS MANUFACTURE PHILIPS GLOEILAMPENFAB:NV 1989-12-20 JP disclosed
US-4792506-A FREE RADICAL POLYMERIZATION OF VINYL MONOMERS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1988-12-20 US disclosed
EP-0260877-A2 Photosensitizers and polymerizable compositions MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1988-03-23 EP disclosed