SCHEMBL774853

SCHEMBL774853

C=C(C)C(=O)OCC(=O)N1C(=O)C2CC(O)CC21

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.34
F2 P00734 2/20 0.34
TSHR P16473 1/20 0.31
KMT2A Q03164 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
SCHEMBL775162 0.91 F2 (0.34) ALDH1A1F2
SCHEMBL775401 0.86 ALDH1A1 (0.33) ALDH1A1F2TSHRKMT2A
SCHEMBL775279 0.84 F2 (0.34) ALDH1A1F2KMT2A
SCHEMBL775168 0.84 F2 (0.36) ALDH1A1F2
SCHEMBL775161 0.84 F2 (0.34) ALDH1A1F2
SCHEMBL775415 0.82 F2 (0.33) ALDH1A1F2
SCHEMBL9915987 0.81 HTT (0.36) ALDH1A1F2TSHRKMT2A
SCHEMBL774995 0.81 ALDH1A1 (0.36) ALDH1A1F2TSHRKMT2A
SCHEMBL9915991 0.80 HTT (0.35) ALDH1A1F2TSHRKMT2A
SCHEMBL9915990 0.80 HTT (0.35) ALDH1A1F2TSHRKMT2A

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