SCHEMBL7108352

SCHEMBL7108352

COc1ccc(C(=O)O)nc1Oc1cccc(C(F)(F)F)c1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.53
PPP1CA P62136 1/20 0.52
KMT2A Q03164 1/20 0.52
ABCG2 Q9UNQ0 1/20 0.47
CYP1A2 P05177 2/20 0.47
CYP2C9 P11712 2/20 0.47
CYP2C19 P33261 2/20 0.47
RECQL P46063 1/20 0.47
BRAF P15056 1/20 0.46
P2RY1 P47900 2/20 0.46
KDM4E B2RXH2 3/20 0.46
ALDH1A1 P00352 1/20 0.46
L3MBTL1 Q9Y468 3/20 0.46
NPSR1 Q6W5P4 3/20 0.46
LMNA P02545 1/20 0.44
MRGPRX4 Q96LA9 1/20 0.44
ADORA2A P29274 1/20 0.44
PPARG P37231 2/20 0.44
F10 P00742 1/20 0.43

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
SCHEMBL7106274 0.89 MAPT (0.67) MAPTPPP1CAKMT2ACYP1A2CYP2C9
SCHEMBL8069371 0.88 MAPT (0.55) MAPTPPP1CAKMT2ABRAFP2RY1
SCHEMBL7110619 0.77 MAPT (0.74) MAPTABCG2CYP1A2CYP2C9CYP2C19
SCHEMBL7049881 0.77 MAPT (0.63) MAPTPPP1CAKMT2AABCG2CYP1A2
SCHEMBL9360774 0.74 KDM4E (0.75) MAPTKMT2ACYP1A2CYP2C9CYP2C19
SCHEMBL28320654 0.74 MAPT (0.50) MAPTKMT2AABCG2CYP1A2CYP2C9
SCHEMBL8721822 0.74 MAPT (0.50) MAPTKMT2AABCG2P2RY1KDM4E
SCHEMBL11412080 0.74 CDK8 (0.55) MAPTALDH1A1L3MBTL1MRGPRX4PPARG
SCHEMBL7108274 0.73 MAPT (0.61) MAPTKMT2ACYP1A2CYP2C9CYP2C19
SCHEMBL6826997 0.73 PPP1CA (0.65) MAPTPPP1CAKMT2AABCG2CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0949248-B1 6-(NONSUBSTITUTED OR SUBSTITUTED) PHENOXYPICOLINIC ACIDS, PROCESS OF PREPARING THE SAME, AND AGRICULTURAL/HORTICULTURAL GERMICIDES CONTAINING THE SAME KUREHA CHEMICAL IND CO LTD (JP) 2003-10-08 EP disclosed
US-6200933-B1 LOW TOXICITY TO HUMANS AND CATTLE KUREHA KAGAKU KABUSHIKI KAISHA (JP) 2001-03-13 US disclosed
US-6159901-A 6-phenoxy picolinic acid alkylidene hydrazide derivative, process for producing the same and herbicide using the same KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 2000-12-12 US disclosed
EP-1020444-A1 6-PHENOXYPICOLINIC ACID, ALKYLIDENEHYDRAZIDE DERIVATIVES, PROCESS FOR PRODUCING THE SAME, AND HERBICIDE KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 2000-07-19 EP disclosed
EP-0949248-A1 6-(NONSUBSTITUTED OR SUBSTITUTED) PHENOXYPICOLINIC ACIDS, PROCESS OF PREPARING THE SAME, AND AGRICULTURAL/HORTICULTURAL GERMICIDES CONTAINING THE SAME KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1999-10-13 EP disclosed