SCHEMBL10926181

SCHEMBL10926181

O=C(c1ccc(F)cc1)c1noc(CN2CCN(C(c3ccccc3)c3ccccc3)CC2)n1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.60
▸ HTT P42858 1/20 0.60
▸ NPSR1 Q6W5P4 1/20 0.60
▸ ATM Q13315 3/20 0.56
▸ MEN1 O00255 3/20 0.56
▸ KMT2A Q03164 3/20 0.56
▸ CYP3A4 P08684 1/20 0.55
▸ CYP2C9 P11712 1/20 0.55
▸ CYP2C19 P33261 1/20 0.55
▸ HDAC1 Q13547 2/20 0.47
▸ KCNH2 Q12809 2/20 0.47
▸ HDAC4 P56524 1/20 0.47
▸ PKM P14618 1/20 0.46
▸ CACNA2D1 P54289 1/20 0.46
▸ CACNA1B Q00975 1/20 0.46
▸ CACNB1 Q02641 1/20 0.46
▸ CACNA1C Q13936 1/20 0.46
▸ DRD2 P14416 2/20 0.44
▸ DRD4 P21917 2/20 0.44
▸ DRD3 P35462 2/20 0.44

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
SCHEMBL10925160 0.96 LMNA (0.57) LMNAHTTNPSR1ATMMEN1
SCHEMBL10928162 0.93 LMNA (0.66) LMNAHTTNPSR1ATMMEN1
SCHEMBL10929942 0.88 ALDH1A1 (0.47) LMNAHTTNPSR1ATMMEN1
SCHEMBL10925916 0.87 LMNA (0.57) LMNAHTTNPSR1ATMCYP3A4
SCHEMBL10930333 0.84 ALDH1A1 (0.40) LMNAHTTNPSR1KMT2ACYP3A4
SCHEMBL10925857 0.84 ALDH1A1 (0.54) LMNA
SCHEMBL10930339 0.81 MAPK1 (0.40) LMNAKMT2AKCNH2PKM
SCHEMBL10922803 0.80 MEN1 (0.57) LMNAHTTNPSR1ATMMEN1
SCHEMBL10993952 0.80 SMN1; SMN2 (0.48) LMNAHTTNPSR1ATMMEN1
Hydrochloric Acid SCHEMBL10926536 0.79 NPC1 (0.47) LMNAHTTNPSR1ATMMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4562186-A HYPOTENSIVE, ANALGESICS, AND ANTIINFLAMMATORY AGENTS HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1985-12-31 — — US claimed
EP-0189080-A2 (1,2,4-Oxadiazol-3-YL)-arylmethanones, a process for their preparation and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1986-07-30 — — EP disclosed
US-4562186-A HYPOTENSIVE, ANALGESICS, AND ANTIINFLAMMATORY AGENTS HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1985-12-31 — — US disclosed
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