SCHEMBL6561252

SCHEMBL6561252

COc1ccc(C=Cc2cccc[n+]2C)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.59
KMT2A Q03164 2/20 0.59
TRPA1 O75762 1/20 0.59
RAB9A P51151 3/20 0.56
PABPC1 P11940 2/20 0.55
EIF4H Q15056 1/20 0.55
ESR1 P03372 2/20 0.53
ABL1 P00519 1/20 0.53
TTR P02766 1/20 0.53
CYP1A1 P04798 1/20 0.53
CYP1A2 P05177 1/20 0.53
ABCB1 P08183 1/20 0.53
ALOX5 P09917 1/20 0.53
BCR P11274 1/20 0.53
CYP19A1 P11511 1/20 0.53
NQO2 P16083 1/20 0.53
PTGS2 P35354 1/20 0.53
CYP1B1 Q16678 1/20 0.53
TUBB4A P04350 1/20 0.53
TUBB P07437 1/20 0.53

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
SCHEMBL14101483 1.00 MEN1 (0.59) MEN1KMT2ATRPA1RAB9APABPC1
Iodide SCHEMBL6559782 0.98 MEN1 (0.62) MEN1KMT2ATRPA1RAB9APABPC1
Iodide SCHEMBL6858468 0.98 MEN1 (0.62) MEN1KMT2ATRPA1RAB9APABPC1
SCHEMBL18434798 0.84 MEN1 (0.60) MEN1KMT2ARAB9APABPC1EIF4H
SCHEMBL8740710 0.83 RELA (0.49) MEN1KMT2ATRPA1RAB9APABPC1
SCHEMBL7994350 0.82 CHAT (0.63) MEN1KMT2ARAB9APABPC1EIF4H
SCHEMBL29620211 0.82 CHAT (0.63) MEN1KMT2ARAB9APABPC1EIF4H
SCHEMBL5865302 0.82 NPC1 (0.63) MEN1KMT2ATRPA1RAB9AESR1
SCHEMBL5865301 0.82 NPC1 (0.63) MEN1KMT2ATRPA1RAB9AESR1
Iodide SCHEMBL6559498 0.81 GAA (0.64) MEN1KMT2ARAB9APABPC1EIF4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1432394-A1 AGENT FOR COLORING KERATIN FIBERS Henkel Kommanditgesellschaft auf Aktien (DE) 2004-06-30 EP claimed
WO-2003030846-A1 AGENT FOR COLORING KERATIN FIBERS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2003-04-17 WO claimed
EP-0442638-B1 Polymeric compounds DU PONT UK (GB) 1996-07-10 EP disclosed
US-5278022-A Photopolymerizable E. I. DU PONT DE NEMOURS AND COMPANY (US) 1994-01-11 US disclosed
EP-0358400-B1 Improvements in or relating to polymeric compounds DU PONT (US) 1993-11-10 EP disclosed
US-5162431-A Photosensitive Binders DU PONT-HOWSON LIMITED (GB) 1992-11-10 US disclosed
US-5120799-A POLYMERIC COMPOUNDS HAVING PENDANT SULPHONATO GROUPS AND METHOD OF PRODUCING THE POLYMERIC COMPOUNDS E. I. DU PONT DE NEMOURS AND COMPANY (INC.) (US) 1992-06-09 US disclosed
EP-0442638-A2 Polymeric compounds Du Pont (UK) Limited (GB) 1991-08-21 EP disclosed
EP-0358400-A2 Improvements in or relating to polymeric compounds E.I. DU PONT DE NEMOURS AND COMPANY (US) 1990-03-14 EP disclosed