SCHEMBL16236329

SCHEMBL16236329

CC(=O)Oc1ccc(C)c(C)c1-c1c(OC(=O)C(C)(C)C)ccc(C)c1C

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 1/20 0.43
▸ ELANE P08246 12/20 0.42
▸ ACHE P22303 2/20 0.41
▸ PIM1 P11309 1/20 0.41
▸ KMT2A Q03164 1/20 0.39
▸ ALDH1A1 P00352 2/20 0.37
▸ LMNA P02545 1/20 0.37
▸ CYP3A4 P08684 1/20 0.37
▸ HIF1A Q16665 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ TSHR P16473 1/20 0.37
▸ RAB9A P51151 1/20 0.37

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
SCHEMBL16239375 0.93 ELANE (0.47) ELANEALDH1A1LMNACYP3A4HIF1A
SCHEMBL16239270 0.87 ELANE (0.42) ELANEKMT2AALDH1A1LMNACYP3A4
SCHEMBL16236717 0.86 ELANE (0.41) ELANEPIM1ALDH1A1LMNACYP3A4
Hydrochloric Acid SCHEMBL16237201 0.84 ELANE (0.41) ELANEALDH1A1LMNACYP3A4HIF1A
Hydrochloric Acid SCHEMBL16237202 0.84 ELANE (0.41) ELANEALDH1A1LMNACYP3A4HIF1A
SCHEMBL16236575 0.82 TYMS (0.40) ELANEKMT2AALDH1A1LMNACYP3A4
Hydrochloric Acid SCHEMBL16237049 0.82 ELANE (0.39) ELANEALDH1A1LMNACYP3A4HIF1A
SCHEMBL16236880 0.81 TSHR (0.47) PTPN1ACHEPIM1ALDH1A1KDM4E
SCHEMBL16237045 0.81 ELANE (0.50) ELANEKMT2A
SCHEMBL16236511 0.80 PIM1 (0.58) PTPN1ELANEACHEPIM1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2997050-B1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE ITALIA SRL (IT) 2018-01-17 — — EP disclosed
US-9714303-B2 Catalyst components for the polymerization of olefins BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2017-07-25 — — US disclosed
US-20160115261-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS Basell Poliolefine Italia, s.r.l. (IT) 2016-04-28 — — US disclosed
EP-2997050-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS Basell Poliolefine Italia S.r.l. (IT) 2016-03-23 — — EP disclosed
WO-2014184171-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2014-11-20 — — WO disclosed
EP-2803678-A1 Catalyst components for the polymerization of olefins Basell Poliolefine Italia S.r.l. (IT) 2014-11-19 — — EP disclosed
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