SCHEMBL23976215

SCHEMBL23976215

CN1CCC(Oc2ccnc(-c3nc4c(c(N(C)CC(=O)NC5(C(F)(F)F)CC5)n3)CCC4)c2)C1

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SYK P43405 5/20 0.33
CACNA1H O95180 1/20 0.33
SPR P35270 1/20 0.33
ACACB O00763 8/20 0.32
BRAF P15056 1/20 0.32
KDR P35968 1/20 0.32
LNPEP Q9UIQ6 1/20 0.31
CTSL P07711 1/20 0.31
CTSB P07858 1/20 0.31
CTSS P25774 1/20 0.31
GCK P35557 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
SCHEMBL23976219 1.00 SYK (0.33) SYKCACNA1HSPRACACBBRAF
SCHEMBL23975672 0.89 SYK (0.38) SYK
SCHEMBL30118646 0.87 SYK (0.35) SYKSPRACACBLNPEPGCK
SCHEMBL30118726 0.87 SYK (0.35) SYKSPRACACBLNPEPGCK
SCHEMBL23976179 0.87 SYK (0.35) SYKSPRACACBLNPEPGCK
SCHEMBL23976471 0.87 SYK (0.35) SYKSPRACACBLNPEPGCK
SCHEMBL23976645 0.87 SYK (0.35) SYKSPRACACBLNPEPGCK
SCHEMBL23976799 0.87 HDAC1 (0.35) SYKCACNA1HSPR
SCHEMBL30118813 0.87 HDAC1 (0.35) SYKCACNA1HSPR
SCHEMBL23976813 0.84 SYK (0.34) SYKACACB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021222483-A1 METHODS OF USE FOR PYRIMIDINES AS FERROPORTIN INHIBITORS GLOBAL BLOOD THERAPEUTICS, INC. (US) 2021-11-04 WO disclosed
WO-2021222363-A1 CYCLOALKYL PYRIMIDINES AS FERROPORTIN INHIBITORS GLOBAL BLOOD THERAPEUTICS, INC. (US) 2021-11-04 WO disclosed