SCHEMBL11675751

SCHEMBL11675751

Cc1ccc(C(=O)N(N)c2ccccc2)cc1C

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.54
CES1 P23141 1/20 0.54
LMNA P02545 2/20 0.51
ALDH1A1 P00352 4/20 0.49
CYP1A2 P05177 1/20 0.49
CYP3A4 P08684 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
KMT2A Q03164 3/20 0.48
MEN1 O00255 2/20 0.48
NPC1 O15118 3/20 0.45
POLB P06746 2/20 0.45
MITF O75030 1/20 0.45
RAB9A P51151 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
MAPT P10636 1/20 0.43
HPGD P15428 1/20 0.43
CASP3 P42574 1/20 0.43
SENP8 Q96LD8 1/20 0.43
SENP7 Q9BQF6 1/20 0.43

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
SCHEMBL11674693 0.85 KMT2A (0.40) CES2CES1CYP3A4CYP2C9CYP2C19
SCHEMBL28484796 0.83 CES2 (0.50) CES2CES1LMNAALDH1A1CYP1A2
SCHEMBL10949416 0.82 NPSR1 (0.50) CES2CES1ALDH1A1KMT2AMEN1
SCHEMBL11674132 0.81 TSHR (0.60) CES2CES1ALDH1A1KMT2AMEN1
SCHEMBL11254594 0.81 CES2 (0.52) CES2CES1LMNAALDH1A1CYP1A2
SCHEMBL11672970 0.80 HPGD (0.54) CYP3A4CYP2C9CYP2C19KMT2AMEN1
Hydrochloric Acid SCHEMBL11834225 0.79 CES2 (0.50) CES2CES1LMNAALDH1A1CYP1A2
SCHEMBL11673208 0.79 TPMT (0.45) KMT2APOLBSMN1; SMN2PLAU
Hydrochloric Acid SCHEMBL11843807 0.79 HPGD (0.53) CYP3A4CYP2C9CYP2C19KMT2AMEN1
SCHEMBL11848661 0.78 ESR1 (0.59) CES2CES1ALDH1A1CYP3A4KMT2A

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-4017540-A INSECTICIDES, MITICIDES THE UPJOHN COMPANY (US) 1977-04-12 US disclosed
US-3932661-A Anthelmintic methods employing benzoyl chloride phenylhydrazones THE UPJOHN COMPANY (US) 1976-01-13 US disclosed