SCHEMBL288623

SCHEMBL288623

O=C(O)N1CCCCC1Oc1cc(Cl)ncn1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 2/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
KMO O15229 3/20 0.34
HPGD P15428 3/20 0.34
NPC1 O15118 3/20 0.34
LMNA P02545 2/20 0.34
RAB9A P51151 2/20 0.34
ALDH1A1 P00352 1/20 0.34
HTT P42858 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
HCRTR1 O43613 1/20 0.34
CPT2 P23786 1/20 0.33
CPT1A P50416 1/20 0.33
OPRK1 P41145 3/20 0.32
PREP P48147 2/20 0.32
TSHR P16473 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
POLB P06746 1/20 0.32
FAP Q12884 1/20 0.32

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
SCHEMBL1445594 0.83 GPR119 (0.40) S1PR1PREPFAPCYP2C9
SCHEMBL288498 0.74 ACACB (0.34) KMT2AKMOHPGDALDH1A1HCRTR1
SCHEMBL289843 0.74 EGFR (0.41) S1PR1
SCHEMBL3722586 0.73 MEN1 (0.52) S1PR1MEN1KMT2AKMOPREP
SCHEMBL557714 0.72 S1PR1 (0.50) S1PR1MEN1KMT2AKMO
SCHEMBL5399844 0.70 S1PR1 (0.52) S1PR1MEN1KMT2AKMO
SCHEMBL5405665 0.70 S1PR1 (0.52) S1PR1MEN1KMT2AKMO
SCHEMBL5413053 0.69 MEN1 (0.40) S1PR1MEN1KMT2AKMO
SCHEMBL5413891 0.69 MEN1 (0.40) S1PR1MEN1KMT2AKMO
SCHEMBL17559337 0.68 GPR119 (0.49) S1PR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2427450-A1 GPR 119 MODULATORS Pfizer Inc. (US) 2012-03-14 EP disclosed
EP-2427448-A1 Gpr 119 modulators Pfizer Inc. (US) 2012-03-14 EP disclosed
WO-2010128414-A1 GPR 119 MODULATORS PFIZER INC. (US) 2010-11-11 WO disclosed
WO-2010128425-A1 GPR 119 MODULATORS PFIZER INC. (US) 2010-11-11 WO disclosed