SCHEMBL20164249

SCHEMBL20164249

CCOC(=O)Nc1cc(C(C)(C)C)cc(C)c1OC(=O)c1cccc(Cl)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.46
LMNA P02545 2/20 0.42
TP53 P04637 1/20 0.42
SMN1; SMN2 Q16637 4/20 0.41
TRPV1 Q8NER1 1/20 0.41
MAPT P10636 3/20 0.41
KMT2A Q03164 2/20 0.41
PKM P14618 1/20 0.41
NPC1 O15118 3/20 0.39
RAB9A P51151 2/20 0.39
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
MAPK1 P28482 1/20 0.39
HTT P42858 1/20 0.39
NLRP3 Q96P20 1/20 0.39
CYP1A2 P05177 2/20 0.39
CYP2C9 P11712 2/20 0.39
CYP2C19 P33261 2/20 0.39
HPGD P15428 2/20 0.39
GAA P10253 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
SCHEMBL18249409 0.88 SMN1; SMN2 (0.49) ALDH1A1LMNATP53SMN1; SMN2TRPV1
SCHEMBL20164265 0.88 SMN1; SMN2 (0.44) ALDH1A1LMNASMN1; SMN2TRPV1MAPT
SCHEMBL18249380 0.88 KMT2A (0.46) ALDH1A1LMNASMN1; SMN2MAPTKMT2A
SCHEMBL18249488 0.86 ALDH1A1 (0.54) ALDH1A1LMNATP53SMN1; SMN2TRPV1
SCHEMBL20164237 0.85 KMT2A (0.47) ALDH1A1LMNATP53SMN1; SMN2TRPV1
SCHEMBL15535214 0.80 LMNA (0.42) ALDH1A1LMNATP53SMN1; SMN2TRPV1
SCHEMBL20164293 0.80 SMN1; SMN2 (0.41) ALDH1A1LMNASMN1; SMN2MAPTKDM4E
SCHEMBL16236470 0.79 LMNA (0.42) ALDH1A1LMNATP53SMN1; SMN2TRPV1
SCHEMBL25921373 0.79 KMT2A (0.48) ALDH1A1LMNATP53SMN1; SMN2MAPT
SCHEMBL15535057 0.78 LMNA (0.41) ALDH1A1LMNATP53SMN1; SMN2TRPV1

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