SCHEMBL3022237

SCHEMBL3022237

C=C(C)C(=O)OC1CCC(C2CCCCC2)CC1

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 3/20 0.37
ALDH1A1 P00352 2/20 0.35
NAAA Q02083 2/20 0.34
HCRTR2 O43614 1/20 0.34
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CYP2C19 P33261 1/20 0.32
THRB P10828 1/20 0.32
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 1/20 0.31
CYP19A1 P11511 2/20 0.30

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
SCHEMBL18522594 0.93 ALDH1A1 (0.35) EPHX1ALDH1A1NAAAHTTTHRB
SCHEMBL9972479 0.92 ALDH1A1 (0.41) ALDH1A1THRB
SCHEMBL2779120 0.89 ALDH1A1 (0.33) ALDH1A1HCRTR2THRB
SCHEMBL887989 0.88 EPHX1 (0.46) EPHX1ALDH1A1NAAAHTTSMN1; SMN2
SCHEMBL16297135 0.88 EPHX1 (0.46) EPHX1ALDH1A1NAAAHTTSMN1; SMN2
SCHEMBL22480 0.88 EPHX1 (0.46) EPHX1ALDH1A1NAAAHTTSMN1; SMN2
SCHEMBL439354 0.88 EPHX1 (0.46) EPHX1ALDH1A1NAAAHTTSMN1; SMN2
SCHEMBL18822970 0.88 EPHX1 (0.46) EPHX1ALDH1A1NAAAHTTSMN1; SMN2
SCHEMBL1052594 0.88 EPHX1 (0.46) EPHX1ALDH1A1NAAAHTTSMN1; SMN2
SCHEMBL28878275 0.88 EPHX1 (0.46) EPHX1ALDH1A1NAAAHTTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4156034-A COPOLYMER OF ACRYLIC ESTER AND STYRENE DERIVATIVE AS COATING AGENT HITACHI, LTD. (JP) 1979-05-22 US claimed
EP-3246375-A1 LIQUID CRYSTALLINE MEDIUM Merck Patent GmbH (DE) 2017-11-22 EP disclosed
EP-2677019-B1 LIQUID CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2017-05-31 EP disclosed
EP-2677018-B1 LIQUID CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2016-11-23 EP disclosed
US-8501331-B2 Binder composition for magnetic recording medium and magnetic recording medium FUJIFILM CORPORATION (JP) 2013-08-06 US disclosed
US-8501331-B2 Binder composition for magnetic recording medium and magnetic recording medium FUJIFILM CORPORATION (JP) 2013-08-06 US disclosed
US-8330902-B2 Display cell with compartmentalized liquid-crystal layer, method for its production and a liquid-crystal material-containing mixture suitable therefor Fraunhofer-Gesellschaft zur Förderung der angewandten Forschung e.V. (DE) 2012-12-11 US disclosed
US-20120165436-A1 PIGMENT DISPERSION CONTAINING AZO PIGMENT AND AQUEOUS INK FOR INKJET RECORDING USING THE SAME FUJIFILM CORPORATION (JP) 2012-06-28 US disclosed
US-20120165436-A1 PIGMENT DISPERSION CONTAINING AZO PIGMENT AND AQUEOUS INK FOR INKJET RECORDING USING THE SAME FUJIFILM CORPORATION (JP) 2012-06-28 US disclosed
US-20110244270-A1 BINDER COMPOSITION FOR MAGNETIC RECORDING MEDIUM AND MAGNETIC RECORDING MEDIUM FUJIFILM CORPORATION (JP) 2011-10-06 US disclosed
US-20110244270-A1 BINDER COMPOSITION FOR MAGNETIC RECORDING MEDIUM AND MAGNETIC RECORDING MEDIUM FUJIFILM CORPORATION (JP) 2011-10-06 US disclosed
US-20110076517-A1 BINDER COMPOSITION FOR MAGNETIC RECORDING MEDIUM AND MAGNETIC RECORDING MEDIUM FUJIFILM CORPORATION (JP) 2011-03-31 US disclosed
US-20110076517-A1 BINDER COMPOSITION FOR MAGNETIC RECORDING MEDIUM AND MAGNETIC RECORDING MEDIUM FUJIFILM CORPORATION (JP) 2011-03-31 US disclosed
US-20100195025-A1 Display Cell with Compartmentalized Liquid-Crystal Layer, Method for its Production and a Liquid-Crystal Material-Containing Mixture Suitable Therefor FRAUNHOFER-GESELLSCHAFT ZUR FOERDERUNG DER ANGEWANDTEN FORSCHUNG E.V. (DE) 2010-08-05 US disclosed
US-4761438-A ACRYLIC AMIDE COPOLYMERS HOYA CORPORATION (JP) 1988-08-02 US disclosed
US-4625009-A POLYMER OF N,N-DIMETHYLACRYLAMIDE, UNSATURATED CARBOXYLIC ACID, HYDROPHOBIC (METH)ACRYLATE ESTER, POLYALKYLENE GLYCOL DI(METH)ACRYLATE HOYA CORPORATION (JP) 1986-11-25 US disclosed
US-4156034-A COPOLYMER OF ACRYLIC ESTER AND STYRENE DERIVATIVE AS COATING AGENT HITACHI, LTD. (JP) 1979-05-22 US disclosed