SCHEMBL9078395

SCHEMBL9078395

O=C(O)Cc1cc(Cl)ccc1OCCCc1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 1/20 0.51
L3MBTL1 Q9Y468 2/20 0.49
ALDH1A1 P00352 1/20 0.49
LMNA P02545 1/20 0.49
MAPT P10636 2/20 0.49
PTGDR2 Q9Y5Y4 2/20 0.47
TP53 P04637 1/20 0.47
HTT P42858 1/20 0.47

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
SCHEMBL9075274 0.93 CHRM1 (0.52) CHRM1MAPT
SCHEMBL2110600 0.85 PTGER1 (0.62) CHRM1
SCHEMBL9077270 0.84 PTGDR2 (0.49) ALDH1A1LMNAPTGDR2HTT
SCHEMBL9077676 0.82 MTNR1B (0.47)
SCHEMBL9077989 0.82 CHRM1 (0.52) CHRM1PTGDR2
SCHEMBL9078338 0.82
SCHEMBL9375792 0.78 HPGD (0.50) CHRM1L3MBTL1ALDH1A1LMNAMAPT
Oxalic Acid SCHEMBL9077330 0.78
SCHEMBL8733926 0.77 HTR2C (0.50) ALDH1A1LMNAPTGDR2HTT
SCHEMBL9077348 0.77 CYP11B1 (0.49)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5495046-A PSYCHOLOGICAL DISORDERS TAISHO PHARMACEUTICAL CO., LTD. (JP) 1996-02-27 US disclosed
EP-0641766-A1 ALKOXYPHENYLALKYLAMINE DERIVATIVE TAISHO PHARMACEUTICAL CO. LTD (JP) 1995-03-08 EP disclosed