SCHEMBL1994420

SCHEMBL1994420

CCC(C=C(C)C(=O)O)(CC)C12CC3CC(CC(C3)C1)C2

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.33
CYP2C9 P11712 1/20 0.33
KMT2A Q03164 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
ALDH1A1 P00352 2/20 0.31
CD81 P60033 1/20 0.31
EPHX2 P34913 1/20 0.30
MEN1 O00255 1/20 0.30
HSD11B1 P28845 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
SCHEMBL1990174 0.83 THRB (0.32) THRBCYP2C9KMT2ASMN1; SMN2ALDH1A1
SCHEMBL701599 0.78 THRB (0.35) THRBCYP2C9KMT2AALDH1A1CD81
SCHEMBL503560 0.78 THRB (0.35) THRBCYP2C9KMT2AALDH1A1CD81
SCHEMBL2196307 0.69 GRM2 (0.36) KMT2ASMN1; SMN2ALDH1A1EPHX2MEN1
Methacrylic Acid SCHEMBL27136409 0.69 KMT2A (0.33) KMT2ASMN1; SMN2ALDH1A1EPHX2MEN1
SCHEMBL1009438 0.68 PTGS1 (0.32) ALDH1A1
SCHEMBL700266 0.68 PKM (0.34) CD81HSD11B1
Methacrylic Acid SCHEMBL27133680 0.68 KMT2A (0.32) KMT2ASMN1; SMN2ALDH1A1EPHX2MEN1
SCHEMBL757168 0.66 THRB (0.39) THRBCYP2C9SMN1; SMN2ALDH1A1CD81
SCHEMBL157720 0.66 THRB (0.39) THRBCYP2C9SMN1; SMN2ALDH1A1CD81

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
US-8431324-B2 Radiation-sensitive resin composition JSR CORPORATION (JP) 2013-04-30 US disclosed
US-20110151378-A1 RADIATION-SENSITIVE RESIN COMPOSITION FOR LIQUID IMMERSION LITHOGRAPHY, POLYMER, AND RESIST PATTERN-FORMING METHOD JSR CORPORATION (JP) 2011-06-23 US disclosed
US-20100285405-A1 RADIATION-SENSITIVE RESIN COMPOSITION JSR CORPORATION (JP) 2010-11-11 US disclosed