SCHEMBL774846

SCHEMBL774846

C=C(C)C(=O)OCC(=O)N1C(=O)CCCCC1C

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.37
KMT2A Q03164 6/20 0.35
ATM Q13315 2/20 0.35
HPGD P15428 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
RECQL P46063 1/20 0.33
MEN1 O00255 3/20 0.32
TSHR P16473 2/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C19 P33261 1/20 0.32
MAPK1 P28482 1/20 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
SCHEMBL774997 0.96 ALDH1A1 (0.38) ALDH1A1KMT2AATMHPGDL3MBTL1
SCHEMBL775145 0.86 ALDH1A1 (0.36) ALDH1A1KMT2AATMTSHR
SCHEMBL774869 0.85 ALDH1A1 (0.35) ALDH1A1KMT2AATMCYP2D6
SCHEMBL775143 0.82 ALDH1A1 (0.38) ALDH1A1KMT2AATMTSHRMAPK1
SCHEMBL775146 0.82 ALDH1A1 (0.37) ALDH1A1KMT2AATMTSHRCYP3A4
SCHEMBL775402 0.81 ALDH1A1 (0.36) ALDH1A1KMT2AATMTSHR
SCHEMBL775267 0.80 ALDH1A1 (0.40) ALDH1A1KMT2AATMTSHRCYP3A4
SCHEMBL774863 0.79 ALDH1A1 (0.37) ALDH1A1KMT2AATMTSHRCYP3A4
SCHEMBL775293 0.78 ALDH1A1 (0.39) ALDH1A1KMT2AATML3MBTL1TSHR
SCHEMBL775400 0.78 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