SCHEMBL2622703

SCHEMBL2622703

C=C(C)C(=O)OC1CCCC(OC(=O)C(C)CC)C1

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.37
ALDH1A1 P00352 1/20 0.33
THRB P10828 1/20 0.32
CHRM2 P08172 1/20 0.31
CHRM1 P11229 1/20 0.31
CHRM3 P20309 1/20 0.31
ADRA1A P35348 1/20 0.31
CHRNA4 P43681 1/20 0.31
HTR3A P46098 1/20 0.31
KCNH2 Q12809 1/20 0.31
CYP19A1 P11511 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
SERPINE1 P05121 1/20 0.31
EPHX1 P07099 1/20 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
SCHEMBL3695491 0.83 SERPINE1 (0.40) TSHRALDH1A1THRBCHRM2CHRM1
SCHEMBL1350834 0.81 EPHX1 (0.43) CHRM2CHRM1CHRM3ADRA1ACHRNA4
SCHEMBL27803283 0.79 SMN1; SMN2 (0.34) TSHRALDH1A1CHRM2CHRM1CHRM3
SCHEMBL2681050 0.78 EPHX1 (0.47) CHRM2CHRM1CHRM3ADRA1ACHRNA4
SCHEMBL786258 0.76 EPHX1 (0.50) ALDH1A1THRBCYP19A1SMN1; SMN2EPHX1
SCHEMBL10033508 0.76 ALDH1A1 (0.42) TSHRALDH1A1THRBCYP19A1
SCHEMBL10658049 0.76 ALDH1A1 (0.33) TSHRALDH1A1THRBSERPINE1EPHX1
SCHEMBL17368471 0.76 DPP4 (0.35) TSHRALDH1A1CHRM2CHRM1CHRM3
SCHEMBL258581 0.76 ALDH1A1 (0.42) TSHRALDH1A1THRBCHRM2CHRM1
SCHEMBL12198883 0.75 CHRM1 (0.33) ALDH1A1CHRM2CHRM1CHRM3ADRA1A

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
US-8163447-B2 Dispersion resin having unsaturation modifier, pigments, photoinitiator and polypentaerythritol polyacrylate compound; tinctorial strength, storage stability, alkali developability; suppressing generation of residues between pixels FUJIFILM CORPORATION (JP) 2012-04-24 US disclosed
US-20080241713-A1 COLORED PHOTOCURABLE COMPOSITION FOR SOLID STATE IMAGE PICK-UP DEVICE, COLOR FILTER AND METHOD FOR PRODUCTION THEREOF, AND SOLID STATE IMAGE PICK-UP DEVICE FUJIFILM CORPORATION (JP) 2008-10-02 US disclosed