SCHEMBL20164233

SCHEMBL20164233

CCOC(=O)Nc1cc2ccccc2cc1OC(=O)c1ccc(Cl)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.49
NPC1 O15118 3/20 0.49
RAB9A P51151 3/20 0.49
LMNA P02545 2/20 0.49
NR1I2 O75469 1/20 0.49
TP53 P04637 1/20 0.49
AHR P35869 1/20 0.49
TAAR1 Q96RJ0 1/20 0.49
CYP2C9 P11712 4/20 0.48
CYP2C19 P33261 4/20 0.48
SMN1; SMN2 Q16637 4/20 0.48
CYP1A2 P05177 3/20 0.48
MEN1 O00255 2/20 0.48
MAOB P27338 1/20 0.48
ALDH1A1 P00352 5/20 0.48
HPGD P15428 1/20 0.48
CYP3A4 P08684 1/20 0.46
ADORA3 P0DMS8 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
HTT P42858 1/20 0.45

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
SCHEMBL20164221 0.90 HPGD (0.52) KMT2ANPC1RAB9ALMNACYP2C9
SCHEMBL18249405 0.85 KMT2A (0.67) KMT2ANPC1RAB9ALMNANR1I2
SCHEMBL20164252 0.83 KMT2A (0.51) KMT2ANPC1RAB9ALMNANR1I2
SCHEMBL20164278 0.80 KMT2A (0.55) KMT2ANPC1RAB9ALMNANR1I2
SCHEMBL20164203 0.80 ALDH1A1 (0.55) KMT2ANPC1RAB9ALMNANR1I2
SCHEMBL3829756 0.77 ALDH1A1 (0.60) KMT2ANPC1RAB9ALMNACYP2C9
SCHEMBL18249416 0.76 ALDH1A1 (0.56) KMT2ANPC1RAB9ALMNANR1I2
SCHEMBL20164255 0.76 TP53 (0.43) KMT2ANPC1RAB9ALMNANR1I2
SCHEMBL18249387 0.75 ALDH1A1 (0.52) KMT2ANPC1RAB9ALMNANR1I2
SCHEMBL28876649 0.75 NLRP3 (0.49) KMT2ANPC1RAB9ALMNANR1I2

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-3298048-B1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE ITALIA SRL (IT) 2019-07-03 EP disclosed
US-10221256-B2 Catalyst components for the polymerization of olefins BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2019-03-05 US disclosed
US-20180142044-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2018-05-24 US disclosed