SCHEMBL10930339

SCHEMBL10930339

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

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 2/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ LMNA P02545 3/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ PKM P14618 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ CASP1 P29466 1/20 0.38
▸ CASP7 P55210 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ HRH3 Q9Y5N1 1/20 0.38
▸ CYP2D6 P10635 1/20 0.38
▸ KCNH2 Q12809 1/20 0.38

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
Hydrochloric Acid SCHEMBL10925679 0.94 SMN1; SMN2 (0.43) MAPK1LMNAKMT2AALDH1A1MAPT
SCHEMBL10993952 0.86 SMN1; SMN2 (0.48) MAPK1LMNAKMT2AALDH1A1MAPT
Hydrochloric Acid SCHEMBL10926536 0.85 NPC1 (0.47) MAPK1LMNAKMT2AALDH1A1MAPT
SCHEMBL10930333 0.83 ALDH1A1 (0.40) MAPK1L3MBTL1LMNAKMT2AALDH1A1
SCHEMBL10925857 0.83 ALDH1A1 (0.54) LMNAALDH1A1MAPTCASP1CASP7
SCHEMBL10926181 0.81 LMNA (0.60) LMNAKMT2APKMKCNH2
SCHEMBL10925160 0.78 LMNA (0.57) MAPK1LMNAKMT2APKMMAPT
SCHEMBL10927399 0.78 TSHR (0.39) LMNATSHRHRH3
SCHEMBL10992668 0.77 MAPT (0.50) LMNAKMT2AALDH1A1MAPTCASP1
SCHEMBL10929942 0.77 ALDH1A1 (0.47) LMNAKMT2AALDH1A1MAPTTSHR

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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