SCHEMBL10926867

SCHEMBL10926867

O=C(c1ccc(F)cc1)c1cc(CN2CCN(C(c3ccc(F)cc3)c3ccc(F)cc3)CC2)on1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.49
▸ KMT2A Q03164 2/20 0.49
▸ ATM Q13315 1/20 0.49
▸ ACHE P22303 5/20 0.46
▸ ALOX5 P09917 1/20 0.45
▸ HRH1 P35367 1/20 0.45
▸ DRD2 P14416 2/20 0.45
▸ DRD4 P21917 2/20 0.45
▸ DRD3 P35462 2/20 0.45
▸ MAPT P10636 2/20 0.43
▸ HTT P42858 2/20 0.43
▸ TP53 P04637 1/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ IGF1R P08069 1/20 0.42
▸ CACNA2D1 P54289 1/20 0.41
▸ CACNA1B Q00975 1/20 0.41
▸ CACNB1 Q02641 1/20 0.41
▸ CACNA1C Q13936 1/20 0.41

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
SCHEMBL10926212 0.95 MEN1 (0.47) MEN1KMT2AATMACHEALOX5
SCHEMBL10923780 0.95 MEN1 (0.55) MEN1KMT2AATMACHEHRH1
SCHEMBL10922803 0.95 MEN1 (0.57) MEN1KMT2AATMDRD2DRD4
SCHEMBL10927224 0.92 ACHE (0.46) MEN1KMT2AATMACHEHRH1
SCHEMBL10950764 0.90 MEN1 (0.55) MEN1KMT2AATMALOX5HRH1
SCHEMBL10927393 0.87 LMNA (0.43) LMNA
SCHEMBL10925373 0.86 MEN1 (0.55) MEN1KMT2AATMALOX5HRH1
SCHEMBL10926835 0.84 HRH1 (0.53) MEN1KMT2AATMALOX5HRH1
SCHEMBL10927399 0.83 TSHR (0.39) LMNA
SCHEMBL10924892 0.82 LMNA (0.51) MEN1KMT2AATMMAPTTP53

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
US-4562187-A HYPOTENSIVE AGENTS, ANTIINFLAMMATORY, AGENTS, AND ANALGESICS HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1985-12-31 — — US claimed
EP-0189771-A3 (ISOXAZOL-3-YL)ARYLMETHANONES, A PROCESS FOR THEIR PREPARATION AND THEIR USE AS MEDICAMENTS HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1986-10-08 — — EP disclosed
EP-0189771-A2 (Isoxazol-3-yl)arylmethanones, a process for their preparation and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1986-08-06 — — EP disclosed
US-4562187-A HYPOTENSIVE AGENTS, ANTIINFLAMMATORY, AGENTS, AND ANALGESICS HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1985-12-31 — — US disclosed
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