SCHEMBL14929438

SCHEMBL14929438

CCC(C)C(=O)OCCC(=O)OC12CC3CC(C1)C(O)C(C3)C2

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 4/20 0.34
TSHR P16473 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
CYP19A1 P11511 3/20 0.32
CYP17A1 P05093 2/20 0.31

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
SCHEMBL14929415 0.88 ALDH1A1 (0.36) EPHX2TSHRNPSR1CYP19A1CYP17A1
SCHEMBL9924486 0.86 CYP19A1 (0.38) TSHRNPSR1CYP19A1CYP17A1
SCHEMBL14929419 0.81 EPHX2 (0.34) EPHX2
SCHEMBL14929420 0.80 EPHX2 (0.34) EPHX2TSHRNPSR1CYP19A1CYP17A1
SCHEMBL14929547 0.78 DPP4 (0.34) EPHX2NPSR1
SCHEMBL2603076 0.77 NPSR1 (0.40) EPHX2TSHRNPSR1CYP19A1CYP17A1
SCHEMBL9916125 0.76 ALDH1A1 (0.43) EPHX2TSHRNPSR1CYP19A1CYP17A1
SCHEMBL9924484 0.74 ALDH1A1 (0.46) NPSR1
SCHEMBL18844982 0.74 CYP19A1 (0.34) TSHRNPSR1CYP19A1CYP17A1
SCHEMBL786179 0.74 CYP19A1 (0.46) EPHX2NPSR1CYP19A1CYP17A1

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-8790867-B2 Methods of forming photolithographic patterns by negative tone development ROHM AND HAAS ELECTRONIC MATERIALS LLC (US) 2014-07-29 US disclosed
US-20130115559-A1 METHODS OF FORMING PHOTOLITHOGRAPHIC PATTERNS BY NEGATIVE TONE DEVELOPMENT ROHM AND HAAS ELECTRONIC MATERIALS LLC (US) 2013-05-09 US disclosed