SCHEMBL10463560

SCHEMBL10463560

CCOC(=O)c1c(C)n(C)cc(-c2ccc(Cl)cc2)c1=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.54
HPGD P15428 4/20 0.54
KDM4E B2RXH2 4/20 0.54
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
PRKCZ Q05513 1/20 0.52
ALOX15 P16050 1/20 0.50
TSHR P16473 1/20 0.50
CASP1 P29466 1/20 0.50
HSD17B10 Q99714 1/20 0.50
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA9 Q16790 1/20 0.47
LMNA P02545 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
NPC1 O15118 1/20 0.46
POLB P06746 1/20 0.46
RAB9A P51151 1/20 0.46
ALOX5 P09917 2/20 0.46

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
SCHEMBL10463165 0.87 HTT (0.50) ALDH1A1HPGDKDM4EMEN1KMT2A
SCHEMBL10463835 0.87 ALDH1A1 (0.54) ALDH1A1HPGDKDM4EMEN1KMT2A
SCHEMBL10462413 0.82 RAB9A (0.46) ALDH1A1HPGDKDM4EMEN1KMT2A
SCHEMBL10460406 0.82 GABRA2 (0.57) ALDH1A1HPGDKDM4EMEN1KMT2A
SCHEMBL10462777 0.81 RAB9A (0.45) ALDH1A1HPGDKDM4EMEN1KMT2A
SCHEMBL10462776 0.80 CA1 (0.38) ALDH1A1HPGDKDM4EMEN1KMT2A
SCHEMBL10463694 0.78 AR (0.57) ALDH1A1HPGDKDM4EMEN1KMT2A
SCHEMBL30880273 0.77 GABRA2 (0.47) ALDH1A1HPGDKDM4EMEN1KMT2A
SCHEMBL30880271 0.77 GABRA2 (0.47) ALDH1A1HPGDKDM4EMEN1KMT2A
SCHEMBL27396018 0.77 GABRA2 (0.47) ALDH1A1HPGDKDM4EMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4964896-A GAMETOCIDES MONSANTO COMPANY (US) 1990-10-23 US disclosed
US-4936904-A Aryl-4-oxonicotinates useful for inducing male sterility in cereal grain plants MONSANTO TECHNOLOGY LLC 1990-06-26 US disclosed
US-4714492-A HYBRIDIZATION AGENTS ROHM AND HAAS COMPANY (US) 1987-12-22 US disclosed