SCHEMBL15565882

SCHEMBL15565882

CCCC[Si](C)(C)OCCN1CCN(c2ccc(B3OC(C)(C)C(C)(C)O3)cc2)CC1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LPL P06858 6/20 0.41
LIPG Q9Y5X9 6/20 0.41
KDM4E B2RXH2 1/20 0.39
GAA P10253 1/20 0.39
DRD2 P14416 3/20 0.38
SIGMAR1 Q99720 1/20 0.36
PLA2G2A P14555 3/20 0.35
MAPT P10636 1/20 0.35
HSD17B10 Q99714 1/20 0.34
HRH3 Q9Y5N1 1/20 0.33
DRD4 P21917 1/20 0.33
THRA P10827 1/20 0.33
THRB P10828 1/20 0.33

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
SCHEMBL21296522 0.84 KDM4E (0.51) LPLLIPGKDM4EGAADRD2
SCHEMBL14852301 0.82 KDM4E (0.59) LPLLIPGKDM4EGAAPLA2G2A
SCHEMBL14852465 0.81 DRD2 (0.54) LPLLIPGKDM4EGAADRD2
SCHEMBL15465594 0.81 MAPT (0.36) LPLLIPGDRD2SIGMAR1MAPT
SCHEMBL19297520 0.78 HSD17B10 (0.44) LPLLIPGKDM4EGAADRD2
SCHEMBL586677 0.76 GAA (0.53) LPLLIPGKDM4EGAASIGMAR1
SCHEMBL586151 0.75 LPL (0.41) LPLLIPGKDM4EGAADRD2
SCHEMBL19583 0.75 ALDH1A1 (0.49) LPLLIPGKDM4EGAAMAPT
SCHEMBL29429852 0.74 MAPT (0.43) LPLLIPGMAPTHSD17B10THRA
SCHEMBL10267432 0.73 KMT2A (0.46) KDM4EGAADRD2MAPTDRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2014026125-A1 PYRAZINE DERIVATIVES AS FGFR INHIBITORS INCYTE CORPORATION (US) 2014-02-13 WO disclosed