SCHEMBL7733259

SCHEMBL7733259

CC1c2ccccc2-c2[nH]c3ccccc3c21

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.44
KMT2A Q03164 4/20 0.44
KDM4E B2RXH2 1/20 0.44
MAPT P10636 1/20 0.44
ALDH1A1 P00352 1/20 0.40
GPR3 P46089 1/20 0.40
HSD17B10 Q99714 1/20 0.40
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
CA4 P22748 2/20 0.39
CA6 P23280 2/20 0.39
HTR2A P28223 4/20 0.38
KCNH2 Q12809 2/20 0.37
HTR2C P28335 1/20 0.37
AHR P35869 1/20 0.37
MAPK10 P53779 1/20 0.37
RIPK1 Q13546 1/20 0.37
PLAU P00749 1/20 0.36
DRD2 P14416 1/20 0.36
DRD1 P21728 1/20 0.36

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
SCHEMBL6151877 0.82 KIF11 (0.47) MEN1KMT2AKDM4EMAPTALDH1A1
SCHEMBL14028585 0.81 SERPINE1 (0.40) MEN1KMT2AKDM4EALDH1A1GPR3
SCHEMBL7124333 0.78 MEN1 (0.41) MEN1KMT2AKDM4EMAPTALDH1A1
SCHEMBL7127330 0.78 KDM4E (0.38) MEN1KMT2AKDM4EMAPTALDH1A1
SCHEMBL7126918 0.77 ALDH1A1 (0.39) MEN1KMT2AKDM4EMAPTALDH1A1
Hydrochloric Acid SCHEMBL8578558 0.77 ALDH1A1 (0.39) MEN1KMT2AKDM4EMAPTALDH1A1
SCHEMBL7130876 0.77 ALDH1A1 (0.39) MEN1KMT2AKDM4EMAPTALDH1A1
SCHEMBL2787277 0.72 KIF11 (0.41) MEN1KMT2AKDM4EMAPTALDH1A1
SCHEMBL4242778 0.71 KDM4E (0.39) KDM4EMAPTALDH1A1CA1CA2
SCHEMBL23740453 0.71 MAPK10 (0.61) MEN1KMT2AKDM4EMAPTCA1

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
US-6376629-B2 ORGANOMETALLIC COMPOUND EQUISTAR CHEMICALS, LP 2002-04-23 US disclosed
US-20010007848-A1 Single-site catalysts for olefin polymerization EQUISTAR CHEMICALS, L.P. 2001-07-12 US disclosed
US-6232260-B1 ORGANOMETALLIC COMPLEX COMPRISES A GROUP 3 TO 10 TRANSITION OR LANTHANIDE METAL, M, AND AT LEAST ONE INDENOINDOLYL LIGAND THAT IS .PI.-BONDED TO M. EQUISTAR CHEMICALS, L.P. 2001-05-15 US disclosed
WO-2001027125-A1 SINGLE-SITE CATALYSTS FOR OLEFIN POLYMERIZATION EQUISTAR CHEMICALS, L.P. (US) 2001-04-19 WO disclosed
US-5185360-A Antioxidants, free radical scavengers UNIVERSITY OF BATH (GB) 1993-02-09 US disclosed
EP-0404536-A1 Indenoindole compounds I UNIVERSITY OF BATH (GB) 1990-12-27 EP disclosed
WO-1990015800-A1 INDENOINDOLE COMPOUNDS UNIVERSITY OF BATH (GB) 1990-12-27 WO disclosed