SCHEMBL2934902

SCHEMBL2934902

O=C(O)c1cc(-c2ccccc2)c2ccccc2c1OCc1c(Cl)ccc(Cl)c1Cl

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 2/20 0.40
PRKAB2 O43741 2/20 0.40
PRKAG1 P54619 2/20 0.40
PRKAA2 P54646 2/20 0.40
PRKAA1 Q13131 2/20 0.40
PRKAG3 Q9UGI9 2/20 0.40
PRKAG2 Q9UGJ0 2/20 0.40
PRKAB1 Q9Y478 2/20 0.40
EIF4E P06730 1/20 0.38
CLCN2 P51788 1/20 0.38
LTB4R Q15722 1/20 0.38
LTB4R2 Q9NPC1 1/20 0.38
P2RY14 Q15391 1/20 0.38
RORC P51449 1/20 0.38
FOLH1 Q04609 1/20 0.37
PTGER4 P35408 1/20 0.37
PTGER3 P43115 1/20 0.37
PTGER2 P43116 1/20 0.37
POLB P06746 1/20 0.37
G6PD P11413 1/20 0.37

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
SCHEMBL2936712 0.88 TRPM4 (0.41) PTGER1EIF4ELTB4RLTB4R2POLB
SCHEMBL2933136 0.76 P2RY14 (0.70) LTB4RLTB4R2P2RY14MAPT
SCHEMBL2970776 0.75 POLB (0.42) LTB4RLTB4R2POLBHSD17B10DHODH
SCHEMBL2927355 0.74 TRPM4 (0.40) EIF4E
SCHEMBL2933942 0.69 MCL1 (0.40) PTGER1LTB4RLTB4R2
SCHEMBL6731841 0.67 ACLY (0.56) PTGER1DHODH
SCHEMBL667582 0.66 PTPN1 (0.59) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL29205045 0.65 MRGPRX4 (0.56) PTGER1FOLH1KDM4E
SCHEMBL28006571 0.64 HSD17B10 (0.67) KDM4EMEN1ALDH1A1MAPTPKM
SCHEMBL21295195 0.64 CLCN2 (0.53) PTGER1CLCN2FOLH1KDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2229373-A1 SUBSTITUTED 2-NAPHTHOIC ACIDS AS ANTAGONISTS OF GPR105 ACTIVITY Merck Frosst Canada Ltd. (CA) 2010-09-22 EP disclosed
WO-2009070873-A1 SUBSTITUTED 2-NAPHTHOIC ACIDS AS ANTAGONISTS OF GPR105 ACTIVITY MERCK FROSST CANADA LTD. (CA) 2009-06-11 WO disclosed