SCHEMBL20164252

SCHEMBL20164252

CCOC(=O)Nc1cccc2cccc(OC(=O)c3ccc(Cl)cc3)c12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.51
LMNA P02545 3/20 0.51
NPC1 O15118 3/20 0.51
RAB9A P51151 2/20 0.51
NR1I2 O75469 1/20 0.51
TP53 P04637 1/20 0.51
AHR P35869 1/20 0.51
TAAR1 Q96RJ0 1/20 0.51
ALDH1A1 P00352 4/20 0.50
HPGD P15428 1/20 0.50
SMN1; SMN2 Q16637 5/20 0.45
MEN1 O00255 3/20 0.44
HTT P42858 2/20 0.44
TRPV1 Q8NER1 2/20 0.43
NPSR1 Q6W5P4 2/20 0.42
ADORA3 P0DMS8 1/20 0.42
CYP2C9 P11712 3/20 0.42
CYP2C19 P33261 3/20 0.42
CYP1A2 P05177 2/20 0.42
ATM Q13315 1/20 0.41

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
SCHEMBL20164238 0.90 ALDH1A1 (0.56) KMT2ALMNANPC1RAB9AALDH1A1
SCHEMBL18249405 0.87 KMT2A (0.67) KMT2ALMNANPC1RAB9ANR1I2
SCHEMBL20164233 0.83 KMT2A (0.49) KMT2ALMNANPC1RAB9ANR1I2
SCHEMBL15233972 0.82 KMT2A (0.44) KMT2ALMNANPC1RAB9ANR1I2
SCHEMBL18249416 0.80 ALDH1A1 (0.56) KMT2ALMNANPC1RAB9ANR1I2
SCHEMBL18249387 0.77 ALDH1A1 (0.52) KMT2ALMNANPC1RAB9ANR1I2
SCHEMBL20164222 0.76 KMT2A (0.54) KMT2ALMNANPC1RAB9ANR1I2
SCHEMBL20164203 0.76 ALDH1A1 (0.55) KMT2ALMNANPC1RAB9ANR1I2
SCHEMBL18249474 0.74 SMN1; SMN2 (0.52) KMT2ALMNANPC1RAB9AALDH1A1
SCHEMBL20164278 0.74 KMT2A (0.55) KMT2ALMNANPC1RAB9ANR1I2

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