SCHEMBL790026

SCHEMBL790026

Cc1cc(C2(c3ccc(N)c(C)c3)CC3CCC2C3)ccc1N

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 10/20 0.45
HSD11B1 P28845 1/20 0.35
ALDH1A1 P00352 3/20 0.35
CYP3A4 P08684 2/20 0.35
TDP1 Q9NUW8 2/20 0.35
TSHR P16473 1/20 0.35
LMNA P02545 1/20 0.31

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
SCHEMBL899767 0.82 ALOX5AP (0.55) ALOX5APHSD11B1TDP1LMNA
SCHEMBL807663 0.77 ALOX5AP (0.55) ALOX5APHSD11B1ALDH1A1LMNA
SCHEMBL28258132 0.77 ALOX5AP (0.40) ALOX5APHSD11B1ALDH1A1CYP3A4TSHR
SCHEMBL979156 0.75 ALOX5AP (0.51) ALOX5APHSD11B1TDP1LMNA
SCHEMBL791198 0.74 ALDH1A1 (0.39) HSD11B1ALDH1A1CYP3A4TDP1TSHR
SCHEMBL28256654 0.73 ALOX5AP (0.38) ALOX5AP
SCHEMBL792713 0.72 ALDH1A1 (0.56) ALDH1A1CYP3A4TDP1TSHRLMNA
Hydrochloric Acid SCHEMBL6098550 0.71 ALDH1A1 (0.55) ALDH1A1CYP3A4TDP1TSHRLMNA
SCHEMBL12948105 0.71 ALOX5AP (0.56) ALOX5APHSD11B1
SCHEMBL9182059 0.70 ALOX5AP (0.55) ALOX5APHSD11B1

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
EP-2616493-B1 POLYMERISATION METHOD UNIV COURT UNIV OF EDINBURGH (GB) 2020-07-01 EP disclosed
US-9018270-B2 Method for producing polymers comprising multiple repeat units of bicyclic diamines UNIVERSITY COLLEGE CARDIFF CONSULTANTS LIMITED (GB) 2015-04-28 US disclosed
US-20130267616-A1 Polymerisation Method UNIVERSITY COLLEGE CARDIFF CONSULTANTS LIMITED (GB) 2013-10-10 US disclosed
EP-2616493-A1 POLYMERISATION METHOD University College Cardiff Consultants, Ltd. (GB) 2013-07-24 EP disclosed
WO-2012035327-A1 POLYMERISATION METHOD UNIVERSITY COLLEGE CARDIFF CONSULTANTS LIMITED (GB) 2012-03-22 WO disclosed