SCHEMBL10854960

SCHEMBL10854960

CCC(O)(c1ccc(OCc2cccc(C)n2)cc1)c1cccc(C(F)(F)F)c1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 7/20 0.41
▸ MRGPRX4 Q96LA9 2/20 0.40
▸ CYSLTR2 Q9NS75 1/20 0.40
▸ CYSLTR1 Q9Y271 1/20 0.40
▸ NR4A2 P43354 1/20 0.40
▸ MAPT P10636 2/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ NPY1R P25929 1/20 0.39
▸ PDE10A Q9Y233 1/20 0.39
▸ FFAR1 O14842 1/20 0.38
▸ FFAR4 Q5NUL3 1/20 0.38
▸ PPARG P37231 2/20 0.38
▸ HTT P42858 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ KCNH2 Q12809 1/20 0.37

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
SCHEMBL10851047 0.93 MRGPRX4 (0.43) MAOBMRGPRX4CYSLTR2CYSLTR1PDE10A
SCHEMBL10853318 0.87 MRGPRX4 (0.41) MAOBMRGPRX4PDE10AFFAR1KCNH2
SCHEMBL10857601 0.86 FFAR1 (0.42) MAPTPDE10AFFAR1KCNH2
SCHEMBL10854791 0.84 KCNH2 (0.40) MAOBMRGPRX4CYSLTR2CYSLTR1MAPT
SCHEMBL10854757 0.84 MRGPRX4 (0.50) MRGPRX4MAPTPDE10AFFAR1KCNH2
SCHEMBL10783493 0.80 NR4A2 (0.55) MAOBMRGPRX4NR4A2MAPTFFAR1
SCHEMBL10856859 0.79 PDE10A (0.38) MRGPRX4CYSLTR2CYSLTR1MAPTPDE10A
SCHEMBL10855266 0.78 MEN1 (0.45) MAPTALDH1A1PDE10AFFAR1KCNH2
SCHEMBL10901479 0.77 NR4A2 (0.52) MAOBMRGPRX4NR4A2MAPTFFAR1
SCHEMBL11116230 0.77 MAOB (0.39) MAOBMRGPRX4NR4A2PDE10AFFAR1

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-0113587-B1 PYRIDINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Richter Gedeon Vegyészeti Gyár R.T. (HU) 1986-12-03 — — EP claimed
US-4598080-A NECROSIS, CARCINOSIS RICHTER GEDEON VEGYESZETI GYAR RT (HU) 1986-07-01 — — US claimed
US-4598080-A NECROSIS, CARCINOSIS RICHTER GEDEON VEGYESZETI GYAR RT (HU) 1986-07-01 — — US disclosed
EP-0113587-A1 Pyridine derivatives, process for their preparation and pharmaceutical compositions containing them Richter Gedeon Vegyészeti Gyár R.T. (HU) 1984-07-18 — — EP disclosed
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