SCHEMBL18249407

SCHEMBL18249407

CCCc1ccc(C(=O)Oc2c(C)cccc2NC(=O)OCC)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 2/20 0.48
ALDH1A1 P00352 3/20 0.48
HPGD P15428 1/20 0.45
KMT2A Q03164 2/20 0.43
RAB9A P51151 3/20 0.42
NPC1 O15118 2/20 0.42
SMN1; SMN2 Q16637 5/20 0.42
LMNA P02545 2/20 0.41
MAPT P10636 2/20 0.41
TP53 P04637 1/20 0.41
CDKN1A P38936 1/20 0.41
GAA P10253 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
HTT P42858 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
MEN1 O00255 1/20 0.39
PLK1 P53350 1/20 0.39
SENP8 Q96LD8 1/20 0.39

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
SCHEMBL28190980 0.87 ALDH1A1 (0.42) NLRP3ALDH1A1HPGDKMT2ARAB9A
SCHEMBL18249430 0.87 KMT2A (0.56) NLRP3ALDH1A1HPGDKMT2ARAB9A
SCHEMBL18249416 0.86 ALDH1A1 (0.56) NLRP3ALDH1A1HPGDKMT2ARAB9A
SCHEMBL18249473 0.85 SMN1; SMN2 (0.50) NLRP3ALDH1A1KMT2ASMN1; SMN2MAPT
SCHEMBL20164263 0.84 KMT2A (0.49) ALDH1A1HPGDKMT2ARAB9ANPC1
SCHEMBL20164212 0.82 ALDH1A1 (0.53) ALDH1A1HPGDKMT2ASMN1; SMN2LMNA
SCHEMBL20164293 0.82 SMN1; SMN2 (0.41) NLRP3ALDH1A1SMN1; SMN2LMNAMAPT
SCHEMBL18249488 0.79 ALDH1A1 (0.54) NLRP3ALDH1A1HPGDKMT2ARAB9A
SCHEMBL18249431 0.79 ALDH1A1 (0.58) NLRP3ALDH1A1HPGDKMT2ARAB9A
SCHEMBL20164292 0.77 THRB (0.38) ALDH1A1KMT2ARAB9ANPC1SMN1; SMN2

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