SCHEMBL7908169

SCHEMBL7908169

COc1cc(C)c(Cl)cc1NC(=O)N(S)c1ccc(NC(=O)c2cc(F)ccc2F)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.45
KDM4E B2RXH2 5/20 0.45
KMT2A Q03164 2/20 0.45
NPC1 O15118 5/20 0.45
RAB9A P51151 4/20 0.45
NPSR1 Q6W5P4 3/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
LMNA P02545 2/20 0.45
MAPT P10636 5/20 0.43
HPGD P15428 1/20 0.43
GAA P10253 1/20 0.42
HTT P42858 1/20 0.42
HDAC3 O15379 1/20 0.42
EGFR P00533 1/20 0.42
HDAC4 P56524 1/20 0.42
HDAC1 Q13547 1/20 0.42
HDAC7 Q8WUI4 1/20 0.42
HDAC2 Q92769 1/20 0.42
HDAC10 Q969S8 1/20 0.42
HDAC11 Q96DB2 1/20 0.42

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
SCHEMBL6814742 0.93 KDM4E (0.54) ALDH1A1KDM4EKMT2ANPC1RAB9A
SCHEMBL6815855 0.90 KMT2A (0.59) ALDH1A1KDM4EKMT2ANPC1RAB9A
SCHEMBL6816082 0.85 ALDH1A1 (0.54) ALDH1A1KDM4EKMT2ANPC1RAB9A
SCHEMBL6814581 0.85 POLB (0.50) ALDH1A1KDM4EKMT2ANPC1RAB9A
SCHEMBL6816227 0.85 ALDH1A1 (0.52) ALDH1A1KDM4EKMT2ANPC1RAB9A
SCHEMBL7908164 0.84 ALDH1A1 (0.50) ALDH1A1KDM4EKMT2ANPC1RAB9A
SCHEMBL6814881 0.82 LMNA (0.54) ALDH1A1KDM4EKMT2ANPC1RAB9A
SCHEMBL6815243 0.82 KMT2A (0.70) ALDH1A1KDM4EKMT2ANPC1RAB9A
SCHEMBL6816061 0.81 KMT2A (0.52) ALDH1A1KDM4EKMT2ANPC1RAB9A
SCHEMBL6812070 0.80 KDM4E (0.69) ALDH1A1KDM4EKMT2ANPC1RAB9A

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-6197803-B1 VIRICIDES; PREVENTION REPRODUCTION AMERICAN HOME PRODUCTS CORPORATION 2001-03-06 US disclosed