SCHEMBL6691372

SCHEMBL6691372

CC(=O)Oc1ccc(C(=O)O)c(I)c1I

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CFD P00746 2/20 0.56
KDM4E B2RXH2 8/20 0.55
ALDH1A1 P00352 4/20 0.55
HSD17B10 Q99714 4/20 0.55
TSHR P16473 3/20 0.55
HPGD P15428 3/20 0.55
TDP1 Q9NUW8 3/20 0.55
PTGS1 P23219 2/20 0.55
PTGS2 P35354 2/20 0.55
ESR1 P03372 1/20 0.55
ITGB3 P05106 1/20 0.55
ITGA2B P08514 1/20 0.55
HMGB1 P09429 1/20 0.55
GGT1 P19440 1/20 0.55
BLM P54132 1/20 0.55
NAPRT Q6XQN6 1/20 0.55
MAPK1 P28482 2/20 0.50
USP2 O75604 1/20 0.49
CYP2C19 P33261 1/20 0.49
LMNA P02545 1/20 0.49

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
SCHEMBL6690410 0.84 KDM4E (0.68) CFDKDM4EALDH1A1HSD17B10TSHR
SCHEMBL28324244 0.81 MAPT (0.55) KDM4EALDH1A1HSD17B10HPGDTDP1
SCHEMBL6696651 0.78 TSHR (0.47) CFDKDM4EALDH1A1HSD17B10TSHR
SCHEMBL3808402 0.77 CYP1A2 (0.58) KDM4EALDH1A1HSD17B10TSHRHPGD
SCHEMBL1319089 0.76 CFD (0.69) CFDKDM4EALDH1A1HSD17B10TSHR
SCHEMBL6691159 0.76 KDM4E (0.67) CFDKDM4EALDH1A1HSD17B10TSHR
SCHEMBL642776 0.76 MAPK1 (0.71) CFDKDM4EALDH1A1HSD17B10TSHR
SCHEMBL11130469 0.76 CFD (0.58) CFDKDM4EALDH1A1HSD17B10TSHR
SCHEMBL6692079 0.74 CFD (0.56) CFDKDM4EALDH1A1HSD17B10TSHR
SCHEMBL6698411 0.74 CFD (0.56) CFDKDM4EALDH1A1HSD17B10TSHR

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