SCHEMBL11049840

SCHEMBL11049840

C=COCC.C=COCCCC

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.40
HPGD P15428 1/20 0.40
ALDH1A1 P00352 3/20 0.36
ADRB2 P07550 1/20 0.36
ADRB1 P08588 1/20 0.36
ADRB3 P13945 1/20 0.36
ATM Q13315 1/20 0.33
CYP3A4 P08684 1/20 0.32
KDM4E B2RXH2 1/20 0.32
MAPT P10636 1/20 0.32
HTT P42858 1/20 0.32
CA1 P00915 1/20 0.30
CA2 P00918 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
SCHEMBL19482 0.92
SCHEMBL27564852 0.90
Water SCHEMBL27695596 0.90 TSHR (0.43) TSHRHPGDALDH1A1ADRB2ADRB1
Ammonia Solution, Strong SCHEMBL27574217 0.90
Water SCHEMBL27572344 0.90
Ethylene SCHEMBL1230162 0.90
Fluoride SCHEMBL27475057 0.90
Ether SCHEMBL8731900 0.88 TSHR (0.39) TSHRHPGDALDH1A1ADRB2ADRB1
SCHEMBL6851146 0.87 TSHR (0.41) TSHRHPGDALDH1A1ADRB2ADRB1
SCHEMBL6559561 0.87 TSHR (0.41) TSHRHPGDALDH1A1ADRB2ADRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103038298-B Coating composition and method for producing coating films ASAHI GLASS CO LTD 2015-03-25 CN disclosed
CN-103038298-A Coating composition and method for producing coating films ASAHI GLASS CO LTD 2013-04-10 CN disclosed
US-4439581-A INTERFACIAL POLYMERIZATION OF A POLYVALENT ISOCYANATE, UNSATURATED SULFONATE POLYMER KANZAKI PAPER MANUFACTURING CO., LTD. (JP) 1984-03-27 US disclosed