SCHEMBL4262104

SCHEMBL4262104

C1=CCCC(C2=COC=C(c3csc(C4CCNCC4)n3)O2)=C1

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HPGDS O60760 1/20 0.39
BAZ2A Q9UIF9 1/20 0.34
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
Bromide SCHEMBL2984494 0.99 HPGDS (0.38) HPGDSBAZ2AMEN1KMT2A
SCHEMBL2976442 0.83 OGA (0.33)
SCHEMBL2969142 0.83
SCHEMBL7238218 0.78 MAPT (0.31) MEN1KMT2A
SCHEMBL4828410 0.69
SCHEMBL3441311 0.69 HRH1 (0.31)
SCHEMBL3544509 0.66 HTR1A (0.33)
SCHEMBL8548883 0.66 BCHE (0.30)
SCHEMBL14746442 0.66 MEN1 (0.48) MEN1KMT2A
SCHEMBL20195251 0.66 HPGDS (0.52) HPGDSBAZ2AMEN1KMT2A

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
EP-1945635-B1 THIAZOLYL PIPERIDINE DERIVATIVES USEFUL AS H3 RECEPTOR MODULATORS HOFFMANN LA ROCHE (CH) 2009-05-06 EP disclosed