SCHEMBL10604889

SCHEMBL10604889

O=C1CCc2ccc(OCCn3ccnc3)cc21

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ HRH3 Q9Y5N1 2/20 0.60
▸ CYP19A1 P11511 1/20 0.55
▸ KDM4E B2RXH2 1/20 0.53
▸ ALDH1A1 P00352 1/20 0.53
▸ MAPK1 P28482 1/20 0.53
▸ NOS1 P29475 1/20 0.53
▸ TBXAS1 P24557 7/20 0.52
▸ HTT P42858 1/20 0.52
▸ PDE3B Q13370 1/20 0.52
▸ PDE3A Q14432 1/20 0.52
▸ MEN1 O00255 1/20 0.51
▸ LMNA P02545 1/20 0.51
▸ KMT2A Q03164 1/20 0.51

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
SCHEMBL6174346 0.90 HRH3 (0.60) HRH3CYP19A1KDM4EALDH1A1MAPK1
SCHEMBL6172429 0.83 HRH3 (0.55) HRH3CYP19A1KDM4EALDH1A1MAPK1
SCHEMBL6174918 0.80 CYP19A1 (0.52) CYP19A1KDM4EALDH1A1MAPK1TBXAS1
SCHEMBL6171877 0.79 MAOB (0.56) CYP19A1KDM4EALDH1A1MAPK1TBXAS1
SCHEMBL4823867 0.79 TBXAS1 (0.48) CYP19A1TBXAS1KMT2A
SCHEMBL577896 0.77 KDM4E (0.58) CYP19A1KDM4EALDH1A1MAPK1NOS1
SCHEMBL330239 0.76 KDM4E (0.57) CYP19A1KDM4EALDH1A1MAPK1NOS1
SCHEMBL6753943 0.76 HMOX1 (0.53) CYP19A1TBXAS1
SCHEMBL4819893 0.76 CYP17A1 (0.56) CYP19A1TBXAS1
SCHEMBL6173341 0.75 CYP19A1 (0.60) CYP19A1ALDH1A1MAPK1NOS1PDE3B

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-4610998-A Imidazolylethoxyindanes and use as antithrombotic agents FERRER INTERNACIONAL, S.A. (ES) 1986-09-09 — — US claimed
EP-0184809-B1 IMIDAZOLYLALKOXYINDANIC DERIVATIVES, A PROCESS FOR PREPARING THEM AND PHARMACEUTICAL COMPOSITION CONTAINING THEM FERRER INTERNACIONAL, S.A. (ES) 1989-08-02 — — EP disclosed
US-4610998-A Imidazolylethoxyindanes and use as antithrombotic agents FERRER INTERNACIONAL, S.A. (ES) 1986-09-09 — — US disclosed
EP-0184809-A1 Imidazolylalkoxyindanic derivatives, a process for preparing them and pharmaceutical composition containing them FERRER INTERNACIONAL, S.A. (ES) 1986-06-18 — — EP disclosed
Send feedback