SCHEMBL774997

SCHEMBL774997

C=C(C)C(=O)OCC(=O)N1C(=O)CCCC1C

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.38
HPGD P15428 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
RECQL P46063 1/20 0.34
KMT2A Q03164 4/20 0.33
ATM Q13315 2/20 0.33
MEN1 O00255 2/20 0.33
TSHR P16473 2/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C19 P33261 1/20 0.32

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
SCHEMBL774846 0.96 ALDH1A1 (0.37) ALDH1A1HPGDL3MBTL1RECQLKMT2A
SCHEMBL775146 0.85 ALDH1A1 (0.37) ALDH1A1KMT2AATMTSHRCYP3A4
SCHEMBL775402 0.84 ALDH1A1 (0.36) ALDH1A1KMT2AATMTSHR
SCHEMBL775143 0.83 ALDH1A1 (0.38) ALDH1A1KMT2AATMTSHR
SCHEMBL775145 0.82 ALDH1A1 (0.36) ALDH1A1KMT2AATMTSHR
SCHEMBL775267 0.81 ALDH1A1 (0.40) ALDH1A1KMT2AATMTSHRCYP3A4
SCHEMBL774869 0.81 ALDH1A1 (0.35) ALDH1A1KMT2AATMCYP2D6
SCHEMBL774863 0.80 ALDH1A1 (0.37) ALDH1A1KMT2AATMTSHRCYP3A4
SCHEMBL775293 0.80 ALDH1A1 (0.39) ALDH1A1L3MBTL1KMT2AATMTSHR
SCHEMBL775400 0.80 ALDH1A1 (0.39) ALDH1A1KMT2AATMTSHRCYP3A4

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