SCHEMBL19601637

SCHEMBL19601637

CC(F)(F)COC(=O)C12CC3CC(C1)C1(OCC(COC(=O)C45CC6CC(CC(C6)C4)C5)(COC(=O)C45CC6CC(C4)C(=O)C(C6)C5)CO1)C(C3)C2

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
ATM Q13315 1/20 0.35
CYP17A1 P05093 2/20 0.33
CYP19A1 P11511 2/20 0.33
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
MAPT P10636 2/20 0.31
POLB P06746 1/20 0.31
GAA P10253 1/20 0.31
TSHR P16473 1/20 0.31
MAPK1 P28482 1/20 0.31
NPSR1 Q6W5P4 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
SCHEMBL17548718 0.99 ALDH1A1 (0.33) ALDH1A1MEN1KMT2AATMCYP17A1
SCHEMBL17548717 0.92 ALDH1A1 (0.37) ALDH1A1MEN1KMT2AATMCYP17A1
SCHEMBL19601041 0.91 ALDH1A1 (0.34) ALDH1A1MEN1KMT2AATMCYP17A1
SCHEMBL19608811 0.88 ALDH1A1 (0.31) ALDH1A1MEN1KMT2AATMCYP17A1
SCHEMBL26029077 0.88 MEN1 (0.32) ALDH1A1MEN1KMT2AATMCYP17A1
SCHEMBL17548721 0.87 MEN1 (0.33) ALDH1A1MEN1KMT2AATMCYP17A1
SCHEMBL17550516 0.87 MEN1 (0.30) ALDH1A1MEN1KMT2AATM
SCHEMBL19601023 0.86 CYP17A1 (0.39) ALDH1A1MEN1KMT2AATMCYP17A1
SCHEMBL17548714 0.85 ALDH1A1 (0.41) ALDH1A1MEN1KMT2AATMNPC1
SCHEMBL26008845 0.84

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-20170329224-A1 PROCESS FOR PRODUCING PHOTORESIST PATTERN AND PHOTORESIST COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-11-16 US disclosed