SCHEMBL9824905

SCHEMBL9824905

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

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.51
TDP1 Q9NUW8 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
ALDH1A1 P00352 2/20 0.44
RAB9A P51151 2/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2C9 P11712 1/20 0.44
NPC1 O15118 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
HDAC1 Q13547 3/20 0.44
HDAC6 Q9UBN7 3/20 0.44
HPGD P15428 1/20 0.42
GAA P10253 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
SCHEMBL4743364 0.83 ALDH1A1 (0.46) POLBTDP1L3MBTL1ALDH1A1RAB9A
SCHEMBL465595 0.81 ALDH1A1 (0.63) POLBTDP1L3MBTL1ALDH1A1CYP3A4
SCHEMBL8179624 0.77 POLB (0.59) POLBTDP1L3MBTL1ALDH1A1CYP3A4
SCHEMBL8167111 0.77 HDAC1 (0.58) POLBTDP1L3MBTL1ALDH1A1HDAC1
SCHEMBL9618235 0.76 HDAC1 (0.56) POLBTDP1L3MBTL1ALDH1A1CYP3A4
SCHEMBL8174284 0.75 ALDH1A1 (0.46) ALDH1A1RAB9ANPC1SMN1; SMN2HDAC1
SCHEMBL1004360 0.75 MLYCD (0.62) L3MBTL1ALDH1A1HDAC1HDAC6HPGD
SCHEMBL10719119 0.75 ABCB1 (0.45) POLBTDP1L3MBTL1ALDH1A1RAB9A
SCHEMBL8177791 0.75 POLB (0.56) POLBTDP1L3MBTL1ALDH1A1CYP3A4
SCHEMBL9277393 0.74 TDP1 (0.50) POLBTDP1L3MBTL1ALDH1A1CYP3A4

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