SCHEMBL10721420

SCHEMBL10721420

Cc1ccc(C(=O)NN(C(=O)c2ccccc2C(F)(F)F)C(C)C(C)(C)C)cc1

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.44
▸ NPC1 O15118 1/20 0.44
▸ ALDH1A1 P00352 2/20 0.44
▸ MAPT P10636 1/20 0.44
▸ ALOX12 P18054 1/20 0.44
▸ HDAC8 Q9BY41 2/20 0.42
▸ GAA P10253 2/20 0.41
▸ KCNK3 O14649 2/20 0.40
▸ KCNK9 Q9NPC2 2/20 0.40
▸ SLC6A2 P23975 1/20 0.39
▸ SLC6A4 P31645 1/20 0.39
▸ TRPV1 Q8NER1 1/20 0.39
▸ HDAC3 O15379 1/20 0.38
▸ HDAC4 P56524 1/20 0.38
▸ HDAC1 Q13547 1/20 0.38
▸ HDAC2 Q92769 1/20 0.38
▸ HDAC6 Q9UBN7 1/20 0.38
▸ RXFP1 Q9HBX9 1/20 0.38

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
SCHEMBL10718578 0.86 ABCB1 (0.45) LMNANPC1HDAC1HDAC6
SCHEMBL10718302 0.82 POLB (0.51) LMNANPC1ALDH1A1MAPT
SCHEMBL9825374 0.77 ABCB1 (0.50) ALDH1A1GAAHDAC1HDAC6
SCHEMBL10719018 0.76 POLB (0.47) LMNAALDH1A1
SCHEMBL9824746 0.75 POLB (0.46) NPC1ALDH1A1
SCHEMBL9877218 0.75 POLB (0.58) LMNAALDH1A1
SCHEMBL10722370 0.73 MEN1 (0.41) LMNANPC1ALDH1A1MAPTGAA
SCHEMBL10718172 0.73 HPGD (0.42) NPC1
SCHEMBL9714393 0.72 POLB (0.67) —
SCHEMBL9825708 0.71 ALDH1A1 (0.46) NPC1ALDH1A1MAPTGAA

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
EP-0236618-A2 Insecticidal N'-substituted-N,N'-diacylhydrazines ROHM AND HAAS COMPANY (US) 1987-09-16 — — EP disclosed
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