SCHEMBL6692084

SCHEMBL6692084

O=C(CCl)Oc1c(Cl)cccc1C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.50
ALDH1A1 P00352 4/20 0.48
KMT2A Q03164 4/20 0.46
HPGD P15428 2/20 0.42
KDM4E B2RXH2 2/20 0.42
HSD17B10 Q99714 2/20 0.42
MAPK1 P28482 1/20 0.42
TP53 P04637 1/20 0.42
HTT P42858 1/20 0.42
FABP3 P05413 3/20 0.42
FABP4 P15090 3/20 0.42
FABP5 Q01469 3/20 0.42
MEN1 O00255 3/20 0.40
PBRM1 Q86U86 1/20 0.40
APEX1 P27695 2/20 0.39
MRGPRX4 Q96LA9 1/20 0.39
NOTUM Q6P988 1/20 0.39
USP2 O75604 1/20 0.39
MT-CO2 P00403 1/20 0.39
LMNA P02545 1/20 0.39

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
SCHEMBL6692076 0.83 MAPK1 (0.58) TSHRALDH1A1KMT2AHPGDKDM4E
SCHEMBL1680473 0.80 TSHR (0.59) TSHRALDH1A1KMT2AHPGDKDM4E
SCHEMBL6689500 0.80 TSHR (0.51) TSHRALDH1A1KMT2AKDM4EHSD17B10
SCHEMBL1315877 0.79 KDM4E (0.67) TSHRALDH1A1KMT2AHPGDKDM4E
SCHEMBL73044 0.77 TSHR (0.59) TSHRALDH1A1KMT2AHPGDKDM4E
SCHEMBL477714 0.75 TSHR (0.57) TSHRALDH1A1KMT2AHPGDKDM4E
SCHEMBL30410031 0.75 TSHR (0.57) TSHRALDH1A1KMT2AHPGDKDM4E
SCHEMBL28022554 0.75 TSHR (0.57) TSHRALDH1A1KMT2AHPGDKDM4E
SCHEMBL28288294 0.75 TSHR (0.57) TSHRALDH1A1KMT2AHPGDKDM4E
SCHEMBL28079050 0.75 TSHR (0.57) TSHRALDH1A1KMT2AHPGDKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0950669-B1 Method of catalytic crosslinking of polymers and two-pack composition used therein ROHM & HAAS (US) 2004-09-08 EP disclosed
US-6306991-B1 TWO PART COATING COMPOSITION WITH TWO CONTAINERS, OXIDATIVE POLYMERS WITH CROSSLINKABLE FUNCTIONAL GROUPS ROHM AND HAAS COMPANY 2001-10-23 US disclosed
US-6149977-A CONTACTING THE OXIDATIVE POLYMER WITH A CATALYTIC AMOUNT OF AN OXIDIZING ENZYME, SUCH AS HORSERADISH PEROXIDASE. ROHM AND HAAS COMPANY (US) 2000-11-21 US disclosed
EP-0950669-A2 Method of catalytic crosslinking of polymers and two-pack composition used therein ROHM AND HAAS COMPANY (US) 1999-10-20 EP disclosed