SCHEMBL775411

SCHEMBL775411

C=C(C)C(=O)OCC(=O)N1C(=O)C2C3CC(C4CC(C)CC43)C21

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
KMT2A Q03164 1/20 0.31
F2 P00734 1/20 0.30
TSHR P16473 2/20 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
SCHEMBL775042 0.91 ALDH1A1 (0.31) ALDH1A1KMT2A
SCHEMBL775041 0.89 ALDH1A1 (0.31) ALDH1A1KMT2AF2
SCHEMBL775169 0.89
SCHEMBL774876 0.82 F2 (0.33) ALDH1A1KMT2AF2
SCHEMBL774879 0.79
SCHEMBL9915992 0.78 KMT2A (0.35) ALDH1A1KMT2A
SCHEMBL775047 0.77 F2 (0.31) F2
SCHEMBL775168 0.73 F2 (0.36) ALDH1A1F2
SCHEMBL775295 0.71 ALDH1A1 (0.30) ALDH1A1TSHR
SCHEMBL775143 0.71 ALDH1A1 (0.38) ALDH1A1KMT2AF2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120070778-A1 RESIN, RESIST COMPOSITION AND METHOD FOR PRODUCING RESIST PATTERN SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-03-22 US disclosed