SCHEMBL9952103

SCHEMBL9952103

O=CCc1cc(Cl)c(F)c(I)c1O

nearest known ligand 0.30

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 2/20 0.30
MEP1A Q16819 1/20 0.30
MEP1B Q16820 1/20 0.30

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
SCHEMBL9952614 0.83 HPGD (0.35) ERN1
SCHEMBL9952114 0.80 MEP1A (0.33) ERN1MEP1AMEP1B
SCHEMBL9953135 0.80 IMPDH2 (0.36) ERN1
SCHEMBL9953163 0.78 IMPDH2 (0.37) MEP1B
SCHEMBL9952884 0.75 LMNA (0.33)
SCHEMBL21812007 0.74 IDO1 (0.37) ERN1
SCHEMBL1905388 0.73 ERCC1 (0.35) ERN1
SCHEMBL9953041 0.72 HPGD (0.42) ERN1
SCHEMBL1578296 0.71 TSHR (0.41) ERN1
SCHEMBL15054235 0.70 MEP1B (0.44) MEP1AMEP1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021158891-A1 SALTS AND SOLID FORMS AND PROCESSES OF PREPARING A PI3K INHIBITOR INCYTE CORPORATION (US) 2021-08-12 WO disclosed
EP-3262046-A1 SALTS OF PI3K INHIBITOR AND PROCESSES FOR THEIR PREPARATION Incyte Corporation (US) 2018-01-03 EP disclosed
WO-2016138363-A1 SALTS OF PI3K INHIBITOR AND PROCESSES FOR THEIR PREPARATION INCYTE CORPORATION (US) 2016-09-01 WO disclosed
EP-2961410-A1 USE OF PYRAZOLOPYRIMIDINE DERIVATIVES FOR THE TREATMENT OF PI3K RELATED DISORDERS Incyte Holdings Corporation (US) 2016-01-06 EP disclosed
WO-2014134426-A1 USE OF PYRAZOLOPYRIMIDINE DERIVATIVES FOR THE TREATMENT OF PI3Kδ RELATED DISORDERS INCYTE CORPORATION (US) 2014-09-04 WO disclosed
EP-2751109-A1 HETEROCYCLYLAMINES AS PI3K INHIBITORS Incyte Corporation (US) 2014-07-09 EP disclosed
EP-2655374-A1 N-(1-(SUBSTITUTED-PHENYL)ETHYL)-9H-PURIN-6-AMINES AS PI3K INHIBITORS Incyte Corporation (US) 2013-10-30 EP disclosed
WO-2013151930-A1 BICYCLIC AZAHETEROCYCLOBENZYLAMINES AS PI3K INHIBITORS INCYTE CORPORATION (US) 2013-10-10 WO disclosed
WO-2013033569-A1 HETEROCYCLYLAMINES AS PI3K INHIBITORS INCYTE CORPORATION (US) 2013-03-07 WO disclosed
WO-2012087881-A1 N-(1-(SUBSTITUTED-PHENYL)ETHYL)-9H-PURIN-6-AMINES AS PI3K INHIBITORS INCYTE CORPORATION (US) 2012-06-28 WO disclosed