SCHEMBL20164291

SCHEMBL20164291

CCCc1ccc(C(=O)Oc2c(N(C)C(=O)OCC)ccc3ccccc23)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NCEH1 Q6PIU2 6/20 0.42
KMT2A Q03164 5/20 0.42
ALDH1A1 P00352 3/20 0.42
NOD2 Q9HC29 1/20 0.42
LMNA P02545 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.37
MEN1 O00255 1/20 0.37
BLM P54132 1/20 0.37
CDC25B P30305 2/20 0.36
APAF1 O14727 1/20 0.36
CASP3 P42574 1/20 0.36
CASP6 P55212 1/20 0.36
SENP8 Q96LD8 1/20 0.36
SENP7 Q9BQF6 1/20 0.36
SENP6 Q9GZR1 1/20 0.36
KDM4E B2RXH2 1/20 0.35
MAPK1 P28482 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
NPC1 O15118 2/20 0.35
NR2F2 P24468 1/20 0.35

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
SCHEMBL20164274 0.89 KMT2A (0.51) NCEH1KMT2AALDH1A1NOD2LMNA
SCHEMBL20164258 0.87 KMT2A (0.43) NCEH1KMT2AALDH1A1NOD2LMNA
SCHEMBL18249412 0.83 MAPT (0.37) KMT2AALDH1A1NOD2LMNASMN1; SMN2
SCHEMBL20164244 0.81 SMN1; SMN2 (0.41) KMT2AALDH1A1LMNASMN1; SMN2MEN1
SCHEMBL20164251 0.80 LMNA (0.46) NCEH1KMT2AALDH1A1NOD2LMNA
SCHEMBL20164262 0.80 NR2F2 (0.36) NCEH1KMT2AALDH1A1SMN1; SMN2MEN1
SCHEMBL15536543 0.79 ALDH1A1 (0.43) KMT2AALDH1A1NOD2LMNASMN1; SMN2
SCHEMBL16236122 0.78 KMT2A (0.43) NCEH1KMT2AALDH1A1NOD2LMNA
SCHEMBL20164212 0.78 ALDH1A1 (0.53) NCEH1KMT2AALDH1A1NOD2LMNA
SCHEMBL18249415 0.78 ABCB1 (0.37) KMT2AALDH1A1NOD2SMN1; SMN2MEN1

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