SCHEMBL4401988

SCHEMBL4401988

CCC(C)c1cccc(O)c1C

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.70
GABRA1 P14867 4/20 0.48
GABRB2 P47870 3/20 0.48
HDAC4 P56524 1/20 0.47
HDAC2 Q92769 1/20 0.47
HDAC8 Q9BY41 1/20 0.47
TRPA1 O75762 2/20 0.45
ATM Q13315 1/20 0.45
RORC P51449 1/20 0.44
HPGD P15428 2/20 0.40
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40
GABRG2 P18507 2/20 0.40
GABRB3 P28472 2/20 0.40
FAAH O00519 1/20 0.40
LMNA P02545 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
GABRB1 P18505 1/20 0.40
PTGS1 P23219 1/20 0.40

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
SCHEMBL18745640 0.85 TSHR (0.58) TSHRGABRA1GABRB2HDAC4HDAC2
SCHEMBL282162 0.83 TSHR (1.00) TSHRGABRA1GABRB2HDAC4HDAC2
SCHEMBL15485172 0.83 TSHR (1.00) TSHRGABRA1GABRB2HDAC4HDAC2
SCHEMBL20721726 0.83 TSHR (1.00) TSHRGABRA1GABRB2HDAC4HDAC2
SCHEMBL23202747 0.82 TSHR (0.50) TSHRGABRA1GABRB2HDAC4HDAC2
SCHEMBL26085068 0.82 TSHR (0.55) TSHRGABRA1GABRB2HDAC4HDAC2
SCHEMBL2784586 0.82 TSHR (0.73) TSHRGABRA1GABRB2HDAC4HDAC2
Hydrochloric Acid SCHEMBL7075092 0.81 TSHR (0.95) TSHRGABRA1GABRB2HDAC4HDAC2
SCHEMBL29178964 0.81 TSHR (0.95) TSHRGABRA1GABRB2HDAC4HDAC2
Benzene SCHEMBL1836843 0.81 TSHR (0.95) TSHRGABRA1GABRB2HDAC4HDAC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8232039-B2 Polymer and resist composition comprising the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-07-31 US disclosed
US-8173352-B2 Resist composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-05-08 US disclosed
US-20100151380-A1 RESIST COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-06-17 US disclosed
US-20100136481-A1 RESIST COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-06-03 US disclosed
US-20100124719-A1 Polymer and Resist Composition Comprising the Same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-05-20 US disclosed
US-20100081085-A1 Polymer and Resist Composition Comprising the Same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-04-01 US disclosed