SCHEMBL14312871

SCHEMBL14312871

Cc1nc(-c2cccc(F)c2)ncc1OC(=O)Nn1c(C)cc2cc(F)ccc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGDS O60760 4/20 0.40
▸ CSNK1D P48730 1/20 0.37
▸ WNT3A P56704 1/20 0.35
▸ PDGFRB P09619 1/20 0.34
▸ PDGFRA P16234 1/20 0.34
▸ HCRTR1 O43613 1/20 0.34
▸ HCRTR2 O43614 1/20 0.34
▸ KCNH2 Q12809 1/20 0.34
▸ PDE10A Q9Y233 1/20 0.33
▸ PSEN1 P49768 1/20 0.33
▸ PSEN2 P49810 1/20 0.33
▸ APH1B Q8WW43 1/20 0.33
▸ NCSTN Q92542 1/20 0.33
▸ APH1A Q96BI3 1/20 0.33
▸ PSENEN Q9NZ42 1/20 0.33
▸ MAPT P10636 2/20 0.33
▸ LMNA P02545 1/20 0.33
▸ GRM5 P41594 1/20 0.33
▸ F10 P00742 1/20 0.33
▸ ALDH1A1 P00352 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
SCHEMBL14312998 0.93 HPGDS (0.38) HPGDSCSNK1DWNT3APDGFRBPDGFRA
SCHEMBL14312772 0.93 HPGDS (0.40) HPGDSCSNK1DWNT3APDGFRBPDGFRA
SCHEMBL14313146 0.92 HPGDS (0.38) HPGDSCSNK1DPDGFRBPDGFRAKCNH2
SCHEMBL14313176 0.90 LMNA (0.39) HPGDSMAPTLMNAF10CYP11B1
SCHEMBL14312733 0.87 CSNK1D (0.39) HPGDSCSNK1DWNT3AF10CYP11B1
SCHEMBL14313023 0.85 HPGDS (0.51) HPGDSMAPTLMNAALDH1A1SMN1; SMN2
SCHEMBL14313255 0.85 HPGDS (0.42) HPGDSCSNK1DWNT3APDGFRBPDGFRA
SCHEMBL12083549 0.83 HPGDS (0.52) HPGDSCSNK1DWNT3APDE10AMAPT
SCHEMBL14312863 0.81 HPGDS (0.41) HPGDSCSNK1DWNT3APDGFRBPDGFRA
SCHEMBL14313439 0.81 HPGDS (0.54) HPGDSCSNK1DWNT3APDGFRBPDGFRA

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-2142516-B1 PYRIMIDINE HYDRAZIDE COMPOUNDS AS PGDS INHIBITORS SANOFI SA (FR) 2012-12-26 — — EP claimed
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