SCHEMBL20164261

SCHEMBL20164261

CCOC(=O)Nc1cc(C(C)(C)C)ccc1OC(=O)C(C)(C)C

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.48
CYP1A2 P05177 3/20 0.47
CYP2C9 P11712 3/20 0.47
CYP2C19 P33261 3/20 0.47
HTT P42858 3/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
MAPK1 P28482 1/20 0.42
RECQL P46063 1/20 0.41
ELANE P08246 1/20 0.41
PRTN3 P24158 1/20 0.41
CYP3A4 P08684 1/20 0.41
TSHR P16473 1/20 0.41
MAPK14 Q16539 1/20 0.40
ALDH1A1 P00352 3/20 0.40
HPGD P15428 1/20 0.40
PKM P14618 1/20 0.40

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
SCHEMBL20164279 0.88 MAPT (0.49) MAPTCYP1A2CYP2C9CYP2C19HTT
SCHEMBL20164276 0.83 MAPT (0.48) MAPTCYP1A2CYP2C9CYP2C19HTT
SCHEMBL18249471 0.81 ALDH1A1 (0.54) MAPTCYP1A2CYP2C9CYP2C19MEN1
SCHEMBL20164278 0.81 KMT2A (0.55) MAPTCYP1A2CYP2C9CYP2C19HTT
SCHEMBL18249441 0.81 SMN1; SMN2 (0.47) MAPTCYP1A2CYP2C9CYP2C19HTT
SCHEMBL20164229 0.80 SMN1; SMN2 (0.43) MAPTCYP1A2CYP2C9CYP2C19HTT
SCHEMBL20164237 0.79 KMT2A (0.47) MAPTCYP1A2CYP2C9CYP2C19HTT
SCHEMBL4822688 0.79 MAPT (0.52) MAPTCYP1A2CYP2C9CYP2C19MEN1
SCHEMBL18249496 0.77 MAPT (0.51) MAPTCYP1A2CYP2C9CYP2C19MEN1
SCHEMBL4826498 0.76 MAPT (0.55) MAPTCYP1A2CYP2C9CYP2C19HTT

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107580607-B Catalyst components for the polymerization of olefins 巴塞尔聚烯烃意大利有限公司 2019-09-27 CN disclosed
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