SCHEMBL10359305

SCHEMBL10359305

OCCOc1cc(Cl)c(Cl)c(Cl)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.46
RECQL P46063 1/20 0.46
CYP1A2 P05177 1/20 0.44
POLB P06746 1/20 0.44
CYP2D6 P10635 1/20 0.44
TSHR P16473 1/20 0.44
CYP2C19 P33261 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
TP53 P04637 2/20 0.41
MAPK1 P28482 1/20 0.41
LMNA P02545 1/20 0.39
MCL1 Q07820 2/20 0.39
CYP3A4 P08684 1/20 0.39
HPGD P15428 1/20 0.39
CRHBP P24387 1/20 0.39
CRHR2 Q13324 1/20 0.39
HSD17B10 Q99714 1/20 0.39
NR1I2 O75469 1/20 0.38
PDK2 Q15119 1/20 0.38
PRKAB2 O43741 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
SCHEMBL16549482 0.86 ALDH1A1 (0.39) ALDH1A1RECQLCYP1A2POLBCYP2D6
SCHEMBL11709179 0.83 ALDH1A1 (0.43) ALDH1A1RECQLCYP1A2POLBCYP2D6
SCHEMBL5378158 0.80 ALDH1A1 (0.59) ALDH1A1RECQLCYP1A2POLBCYP2D6
SCHEMBL9507394 0.79 MAPT (0.50) ALDH1A1RECQLCYP1A2POLBCYP2D6
SCHEMBL10359368 0.79 MAPT (0.55) ALDH1A1RECQLCYP1A2POLBCYP2D6
SCHEMBL77567 0.78 TSHR (0.69) ALDH1A1CYP1A2POLBCYP2D6TSHR
SCHEMBL29450668 0.78 SMN1; SMN2 (0.67) ALDH1A1RECQLPOLBSMN1; SMN2TP53
SCHEMBL9451250 0.78 SMN1; SMN2 (0.67) ALDH1A1RECQLPOLBSMN1; SMN2TP53
SCHEMBL5605139 0.78 SMN1; SMN2 (0.41) ALDH1A1RECQLCYP1A2POLBCYP2D6
SCHEMBL27213493 0.77 TSHR (0.39) ALDH1A1RECQLCYP1A2POLBCYP2D6

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
EP-0391942-A1 PROCESS FOR THE PREPARATION OF ARYLOXYACETIC ACID EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1990-10-17 EP disclosed
US-4935540-A OXIDIZING ARYLOXYETHANOL IN PRESENCE OF PALLADIUM AND THALLIU M ON CARBON CATALYST, ACIDIFYING EASTMAN CHEMICAL COMPANY 1990-06-19 US disclosed
WO-1989003378-A1 PROCESS FOR THE PREPARATION OF ARYLOXYACETIC ACID EASTMAN KODAK COMPANY (US) 1989-04-20 WO disclosed
US-4804777-A OXIDATION OF ARYLOXYETHANOL USING PALLADIUM, SILVER, CARBON CATALYST EASTMAN KODAK COMPANY (US) 1989-02-14 US disclosed
EP-0011793-B1 PROCESS FOR PREPARING ARYLOXYACETIC ACIDS BAYER AG (DE) 1981-09-02 EP disclosed
US-4238625-A ACTIVATORS OF LEAD AND/OR BISMUTH AND/OR THEIR COMPOUNDS FOR OXIDATION WITH PLATINUM OR PALLADIUM CATALYST BAYER AKTIENGESELLSCHAFT (DE) 1980-12-09 US disclosed
EP-0011793-A1 Process for preparing aryloxyacetic acids BAYER AG (DE) 1980-06-11 EP disclosed