SCHEMBL5659440

SCHEMBL5659440

Fc1ccc(-n2ccc3ccc(Cl)cc32)cc1

nearest known ligand 0.54

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BIRC5 O15392 1/20 0.54
KCNH2 Q12809 12/20 0.49
CYP19A1 P11511 1/20 0.49
CDC7 O00311 1/20 0.47
CDK2 P24941 1/20 0.47
ROCK1 Q13464 1/20 0.47
MAP3K14 Q99558 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
SCHEMBL5660143 0.89 BIRC5 (0.67) BIRC5CYP19A1CDC7CDK2ROCK1
SCHEMBL4295429 0.86 KCNH2 (0.60) BIRC5KCNH2CYP19A1
SCHEMBL5660626 0.83 BIRC5 (0.51) BIRC5KCNH2CYP19A1CDC7CDK2
SCHEMBL5660019 0.83 BIRC5 (0.54) BIRC5KCNH2CYP19A1CDC7CDK2
SCHEMBL157573 0.82 BIRC5 (0.62) BIRC5CYP19A1CDC7CDK2ROCK1
SCHEMBL27626324 0.79 BIRC5 (0.50) BIRC5CYP19A1CDC7CDK2ROCK1
Urea SCHEMBL4437676 0.79 ROCK2 (0.54) BIRC5KCNH2
SCHEMBL5661109 0.77 ROCK2 (0.56) BIRC5CYP19A1CDC7CDK2ROCK1
SCHEMBL5659157 0.76 BIRC5 (0.47) BIRC5CYP19A1CDC7CDK2ROCK1
SCHEMBL694975 0.76 KCNH2 (0.46) BIRC5KCNH2CYP19A1CDC7CDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070043080-A1 Substituted anilinic piperidines as MCH selective antagonists MARZABADI MOHAMMAD R 2007-02-22 US disclosed
US-7067534-B1 Substituted anilinic piperidines as MCH selective antagonists H. LUNDBECK A/S (DK) 2006-06-27 US disclosed
CN-1671386-A Substituted anilinic piperidines as MCH selective antagonists LUNDBECK & CO AS H (DK) 2005-09-21 CN disclosed
EP-1411942-A4 SUBSTITUTED ANILINIC PIPERIDINES AS MCH SELECTIVE ANTAGONISTS SYNAPTIC PHARMA CORP (US) 2005-01-26 EP disclosed
EP-1411942-A1 SUBSTITUTED ANILINIC PIPERIDINES AS MCH SELECTIVE ANTAGONISTS Synaptic Pharmaceutical Corporation (US) 2004-04-28 EP disclosed
US-6727264-B1 MELANIN CONCENTRATING HORMONE-1 RECEPTOR ANTAGONISTS; SLEEP, EATING, SEXUAL DISORDERS SYNAPTIC PHARMACEUTICAL CORPORATION 2004-04-27 US disclosed
WO-2003004027-A1 SUBSTITUTED ANILINIC PIPERIDINES AS MCH SELECTIVE ANTAGONISTS SYNAPTIC PHARMACEUTICAL CORPORATION (US) 2003-01-16 WO disclosed
US-5457115-A Treating anxiety, depression, sleep disorders, migranes, schizophrenia or Parkinson's disease in humans H. LUNDBECK A/S (DK) 1995-10-10 US disclosed
EP-0465398-B1 Novel indole derivatives LUNDBECK & CO AS H (DK) 1994-12-14 EP disclosed
US-5322851-A Indole derivatives H. LUNDBECK A/S (DK) 1994-06-21 US disclosed
US-5216001-A Central nervous system disorders H. LUNBECK A/S (DK) 1993-06-01 US disclosed
EP-0465398-A2 Novel indole derivatives H. LUNDBECK A/S (DK) 1992-01-08 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070043080-A1 Substituted anilinic piperidines as MCH selective antagonists MCHR1, MCHR2, MC1R BIRC5 2851/4885KCNH2 2003/4885CYP19A1 487/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.