SCHEMBL1223641

SCHEMBL1223641

CCCCCC(C)CCn1ccnc1

nearest known ligand 0.64

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 12/20 0.64
CYP19A1 P11511 3/20 0.45
QPCT Q16769 2/20 0.43
PRKCI P41743 1/20 0.41

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
SCHEMBL2232319 0.98 TBXAS1 (0.67) TBXAS1CYP19A1QPCT
Hydrochloric Acid SCHEMBL14801508 0.98 TBXAS1 (0.62) TBXAS1CYP19A1QPCTPRKCI
Water SCHEMBL28581002 0.98 TBXAS1 (0.62) TBXAS1CYP19A1QPCTPRKCI
SCHEMBL28191014 0.98 TBXAS1 (0.67) TBXAS1CYP19A1QPCT
Hydrochloric Acid SCHEMBL14802021 0.97 TBXAS1 (0.65) TBXAS1CYP19A1QPCT
SCHEMBL23948110 0.95 TBXAS1 (0.61) TBXAS1CYP19A1QPCTPRKCI
SCHEMBL22313371 0.92 TBXAS1 (0.77) TBXAS1
SCHEMBL19772386 0.88 TBXAS1 (0.66) TBXAS1CYP19A1QPCTPRKCI
SCHEMBL28694303 0.88 TBXAS1 (0.55) TBXAS1CYP19A1QPCTPRKCI
Trifluoromethanesulfonic Acid SCHEMBL5823079 0.85 TBXAS1 (0.48) TBXAS1QPCT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3003250-A1 METHOD OF TREATING KERATIN MATTER BY FORMING AN IONIC LIQUID L'OREAL (FR) 2016-04-13 EP claimed
WO-2014195659-A1 METHOD OF TREATING KERATIN MATTER BY FORMING AN IONIC LIQUID L'OREAL (FR) 2014-12-11 WO claimed
CN-107408730-A Molten salt composition, electrolyte, electric storage device, and method for thickening liquefied molten salt 国立研究开发法人产业技术综合研究所 2017-11-28 CN disclosed
EP-3003250-A1 METHOD OF TREATING KERATIN MATTER BY FORMING AN IONIC LIQUID L'OREAL (FR) 2016-04-13 EP disclosed
WO-2014195659-A1 METHOD OF TREATING KERATIN MATTER BY FORMING AN IONIC LIQUID L'OREAL (FR) 2014-12-11 WO disclosed
US-20110024299-A1 Method for the Electrochemical Coating of a Workpiece EWALD DORKEN AG (DE) 2011-02-03 US disclosed
EP-2280095-A2 Method for electrochemical coating a workpiece EWALD DÖRKEN AG (DE) 2011-02-02 EP disclosed