SCHEMBL9557771

SCHEMBL9557771

Cc1ccc(C(=O)N(C)N(C(=O)c2ccc(F)cc2)C(C)(C)C)cc1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.41
MEN1 O00255 1/20 0.41
ACHE P22303 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
CYP1A2 P05177 2/20 0.40
ALDH1A1 P00352 3/20 0.40
HSD17B10 Q99714 1/20 0.40
LMNA P02545 2/20 0.39
TDP1 Q9NUW8 1/20 0.39
PAX8 Q06710 1/20 0.38
GAA P10253 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
CYP2C19 P33261 1/20 0.38
RECQL P46063 1/20 0.38
TAS2R14 Q9NYV8 1/20 0.37
CES2 O00748 2/20 0.37
CES1 P23141 2/20 0.37
PDK2 Q15119 1/20 0.37

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
SCHEMBL9557376 0.94 KMT2A (0.42) KMT2ACYP1A2CYP2C19RECQLCES2
SCHEMBL9557162 0.92 ALDH1A1 (0.43) KMT2AMEN1SMN1; SMN2ALDH1A1LMNA
SCHEMBL9557428 0.88 RECQL (0.50) KMT2AMEN1CYP1A2HSD17B10LMNA
SCHEMBL9557966 0.86 CES2 (0.50) KMT2AMEN1SMN1; SMN2ALDH1A1LMNA
SCHEMBL9557283 0.86 CES2 (0.50) KMT2AMEN1SMN1; SMN2ALDH1A1LMNA
SCHEMBL9557173 0.85 CYP1A1 (0.50) KMT2AMEN1CES2CES1PDK2
SCHEMBL9557392 0.84 CES2 (0.51) SMN1; SMN2CYP1A2LMNAL3MBTL1CYP2C19
SCHEMBL9557624 0.84 CES2 (0.51) SMN1; SMN2CYP1A2LMNAL3MBTL1CYP2C19
SCHEMBL9558162 0.81 HPGD (0.48) SMN1; SMN2TDP1CYP2C19
SCHEMBL9558095 0.81 ALDH1A1 (0.34) KMT2AMEN1SMN1; SMN2ALDH1A1LMNA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5225443-A Lepidotera and Coleoptera insecticides to protect plants ROHM AND HAAS COMPANY (US) 1993-07-06 US disclosed
EP-0245950-A2 Insecticidal n-substituted-n' - substituted-n, n'-diacylhydrazines ROHM AND HAAS COMPANY (US) 1987-11-19 EP disclosed