SCHEMBL18249381

SCHEMBL18249381

CCCc1ccc(C(=O)OC(C)C(C)C(C)N(C)C(=O)OCC)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.43
CYP4A11 Q02928 1/20 0.43
TAS1R3 Q7RTX0 1/20 0.39
TAS1R1 Q7RTX1 1/20 0.39
MAPT P10636 4/20 0.39
RAB9A P51151 4/20 0.39
NPC1 O15118 3/20 0.39
ALDH1A1 P00352 3/20 0.39
KMT2A Q03164 1/20 0.39
PLK1 P53350 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.36
TSHR P16473 1/20 0.36
THRB P10828 3/20 0.36
ESR1 P03372 2/20 0.35
ESR2 Q92731 2/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA7 P43166 1/20 0.35
CA9 Q16790 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
SCHEMBL18249402 0.85 LMNA (0.41) MAPTRAB9ANPC1ALDH1A1KMT2A
SCHEMBL18249384 0.83 CYP4F2 (0.45) CYP4F2CYP4A11TAS1R3TAS1R1MAPT
SCHEMBL569634 0.82 CYP4A11 (0.57) CYP4F2CYP4A11TAS1R3TAS1R1MAPT
SCHEMBL15233971 0.81 CYP4F2 (0.48) CYP4F2CYP4A11TAS1R3TAS1R1MAPT
SCHEMBL18249393 0.81 CYP4F2 (0.43) CYP4F2CYP4A11TAS1R3TAS1R1MAPT
SCHEMBL20164242 0.80 CYP4F2 (0.42) CYP4F2CYP4A11TAS1R3TAS1R1MAPT
SCHEMBL18249486 0.79 ACHE (0.44) CYP4F2CYP4A11TAS1R3TAS1R1MAPT
SCHEMBL10804604 0.79 CYP4A11 (0.60) CYP4F2CYP4A11TAS1R3TAS1R1MAPT
SCHEMBL18249406 0.77 TSHR (0.42) CYP4F2CYP4A11TAS1R3TAS1R1MAPT
SCHEMBL18249378 0.77 ELANE (0.40) MAPTRAB9ANPC1ALDH1A1L3MBTL1

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 5 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
EP-3298048-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS Basell Poliolefine Italia S.r.l. (IT) 2018-03-28 EP disclosed
WO-2016184884-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2016-11-24 WO disclosed