SCHEMBL9714482

SCHEMBL9714482

CCCc1ccc(C(=S)NN(C(=O)c2ccc(Cl)c(Cl)c2)C(C)(C)C)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ABCB1 P08183 2/20 0.56
▸ HPGD P15428 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ CYP3A4 P08684 3/20 0.45
▸ CYP2C9 P11712 2/20 0.45
▸ MEN1 O00255 1/20 0.45
▸ LMNA P02545 1/20 0.45
▸ CYP1A2 P05177 1/20 0.45
▸ CYP2D6 P10635 1/20 0.45
▸ MAPT P10636 1/20 0.45
▸ CYP2C19 P33261 1/20 0.45
▸ HTT P42858 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ NPSR1 Q6W5P4 1/20 0.45
▸ FAAH O00519 1/20 0.43
▸ MGLL Q99685 1/20 0.43
▸ TSHR P16473 1/20 0.43
▸ GAA P10253 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40

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
SCHEMBL10721281 0.88 ABCB1 (0.71) ABCB1HPGDSMN1; SMN2CYP3A4CYP2C9
SCHEMBL10722318 0.83 MEN1 (0.47) ABCB1CYP3A4CYP2C9MEN1LMNA
SCHEMBL9714478 0.82 ABCB1 (0.56) ABCB1HPGDSMN1; SMN2CYP3A4GAA
SCHEMBL9557692 0.77 TSHR (0.43) ABCB1SMN1; SMN2LMNAMAPTKMT2A
SCHEMBL9558002 0.76 TSHR (0.44) ABCB1SMN1; SMN2MAPTKMT2AFAAH
SCHEMBL9714257 0.76 CYP3A4 (0.60) ABCB1HPGDSMN1; SMN2CYP3A4CYP2C9
SCHEMBL9714435 0.75 ABCB1 (0.72) ABCB1HPGDSMN1; SMN2CYP3A4GAA
SCHEMBL9714441 0.75 ABCB1 (0.72) ABCB1HPGDSMN1; SMN2CYP3A4GAA
SCHEMBL9714325 0.73 CYP3A4 (0.59) ABCB1HPGDSMN1; SMN2CYP3A4CYP2C9
SCHEMBL10721198 0.73 SMN1; SMN2 (0.55) ABCB1HPGDSMN1; SMN2CYP3A4CYP2C9

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
EP-0245950-B1 INSECTICIDAL N-SUBSTITUTED-N' - SUBSTITUTED-N, N'-DIACYLHYDRAZINES ROHM AND HAAS COMPANY (US) 1992-06-17 — — EP disclosed
US-4985461-A Insecticidal N'-substituted-N,N'-diacylhydrazines ROHM AND HAAS COMPANY (US) 1991-01-15 — — US disclosed
EP-0236618-A2 Insecticidal N'-substituted-N,N'-diacylhydrazines ROHM AND HAAS COMPANY (US) 1987-09-16 — — EP disclosed
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