SCHEMBL9826375

SCHEMBL9826375

CC(C)(C)CN(NC(=O)c1ccccc1)C(=O)c1ccccc1Br

nearest known ligand 0.66

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.47
▸ NPC1 O15118 1/20 0.46
▸ RAB9A P51151 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ HPGD P15428 1/20 0.45
▸ CYP3A4 P08684 1/20 0.44
▸ CYP2C9 P11712 1/20 0.44
▸ TDP1 Q9NUW8 1/20 0.42
▸ L3MBTL1 Q9Y468 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
SCHEMBL8179624 0.84 POLB (0.59) POLBSMN1; SMN2CYP3A4CYP2C9TDP1
SCHEMBL9825480 0.82 RAB9A (0.53) POLBNPC1RAB9AKMT2AHPGD
SCHEMBL9824979 0.80 CTSD (0.47) POLBNPC1RAB9ASMN1; SMN2HPGD
SCHEMBL8773659 0.80 POLB (0.70) POLBCYP3A4CYP2C9
SCHEMBL10718357 0.76 CYP3A4 (0.53) POLBNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL9824801 0.76 HDAC1 (0.44) RAB9ASMN1; SMN2MEN1KMT2AHPGD
SCHEMBL9824746 0.75 POLB (0.46) POLBNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL9824961 0.74 SMN1; SMN2 (0.49) POLBNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL10720007 0.72 ABCB1 (0.53) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL9714356 0.71 POLB (0.70) POLBCYP3A4CYP2C9

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-0236618-B1 INSECTICIDAL N'-SUBSTITUTED-N,N'-DIACYLHYDRAZINES ROHM AND HAAS COMPANY (US) 1991-02-27 — — 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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