SCHEMBL5778097

SCHEMBL5778097

COCCCc1cc2c[c]ccc2[nH]1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DAO P14920 1/20 0.39
MTNR1A P48039 4/20 0.38
LOXL2 Q9Y4K0 3/20 0.35
HRH3 Q9Y5N1 4/20 0.35
MTNR1B P49286 3/20 0.34
GHSR Q92847 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.30
GPR84 Q9NQS5 1/20 0.30
CHRNA7 P36544 1/20 0.30
BCHE P06276 1/20 0.30

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
SCHEMBL5778197 0.90 DAO (0.38) DAOMTNR1ALOXL2HRH3MTNR1B
SCHEMBL5778675 0.80 RHEB (0.37) DAOMTNR1ALOXL2HRH3MTNR1B
SCHEMBL694595 0.79 ADORA1 (0.39) MTNR1ALOXL2HRH3MTNR1BSMN1; SMN2
SCHEMBL5178946 0.76 MTNR1A (0.36) MTNR1ALOXL2HRH3MTNR1BCHRNA7
SCHEMBL5777901 0.75 MTNR1A (0.41) MTNR1AMTNR1BSMN1; SMN2
SCHEMBL5780813 0.75 MTNR1A (0.42) MTNR1AMTNR1BSMN1; SMN2
SCHEMBL189125 0.75 LOXL2 (0.37) MTNR1ALOXL2MTNR1B
SCHEMBL188218 0.75 GAA (0.35) MTNR1ALOXL2HRH3MTNR1B
SCHEMBL1661108 0.75 ALDH1A1 (0.39) MTNR1AMTNR1BSMN1; SMN2
SCHEMBL6028297 0.72 CTSV (0.39) DAOMTNR1AMTNR1BGHSRGPR84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1615890-A1 PIPERIDINE DERIVATIVES AS RENIN INHIBITORS FOR THE TREATMENT OF HYPERTENSION WARNER-LAMBERT COMPANY (US) 2006-01-18 EP claimed
WO-2004089903-A9 PIPERIDINE DERIVATIVES AS RENIN INHIBITORS FOR THE TREATMENT OF HYPERTENSION WARNER LAMBERT CO (US) 2005-10-27 WO claimed
WO-2004089903-A1 PIPERIDINE DERIVATIVES AS RENIN INHIBITORS FOR THE TREATMENT OF HYPERTENSION WARNER-LAMBERT COMPANY LLC (US) 2004-10-21 WO claimed
WO-2004089915-A1 PIPERAZINE DERIVATIVE RENIN INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2004-10-21 WO claimed
EP-1615890-A1 PIPERIDINE DERIVATIVES AS RENIN INHIBITORS FOR THE TREATMENT OF HYPERTENSION WARNER-LAMBERT COMPANY (US) 2006-01-18 EP disclosed
WO-2004089903-A9 PIPERIDINE DERIVATIVES AS RENIN INHIBITORS FOR THE TREATMENT OF HYPERTENSION WARNER LAMBERT CO (US) 2005-10-27 WO disclosed
WO-2004089903-A1 PIPERIDINE DERIVATIVES AS RENIN INHIBITORS FOR THE TREATMENT OF HYPERTENSION WARNER-LAMBERT COMPANY LLC (US) 2004-10-21 WO disclosed
WO-2004089915-A1 PIPERAZINE DERIVATIVE RENIN INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2004-10-21 WO disclosed