SCHEMBL5659865

SCHEMBL5659865

O=C(CCCCCCl)c1ccccc1F

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CTNNB1 P35222 10/20 0.54
WNT3A P56704 10/20 0.54
PTPN1 P18031 1/20 0.49
ERCC5 P28715 1/20 0.49
FEN1 P39748 1/20 0.49
ALDH1A1 P00352 1/20 0.48
ALOX15 P16050 1/20 0.48
CES2 O00748 1/20 0.47
CES1 P23141 1/20 0.47
DRD2 P14416 1/20 0.45
L3MBTL1 Q9Y468 2/20 0.44
LMNA P02545 1/20 0.44
MAPT P10636 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
GAA P10253 1/20 0.41

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
SCHEMBL5658640 1.00 CTNNB1 (0.54) CTNNB1WNT3APTPN1ERCC5FEN1
SCHEMBL5661970 0.98 CTNNB1 (0.55) CTNNB1WNT3APTPN1ERCC5FEN1
SCHEMBL1050668 0.93 CTNNB1 (0.57) CTNNB1WNT3APTPN1ERCC5FEN1
SCHEMBL29391353 0.93 CTNNB1 (0.57) CTNNB1WNT3APTPN1ERCC5FEN1
SCHEMBL14732971 0.87 CTNNB1 (0.61) CTNNB1WNT3APTPN1ERCC5FEN1
SCHEMBL8972179 0.85 CTNNB1 (0.56) CTNNB1WNT3APTPN1ERCC5FEN1
SCHEMBL10594894 0.83 HDAC3 (0.53) CTNNB1WNT3APTPN1ERCC5FEN1
SCHEMBL7390218 0.83 CTNNB1 (0.50) CTNNB1WNT3APTPN1ERCC5FEN1
SCHEMBL28223126 0.83 HDAC3 (0.53) CTNNB1WNT3APTPN1ERCC5FEN1
SCHEMBL30089515 0.81 CTNNB1 (0.68) CTNNB1WNT3APTPN1ERCC5FEN1

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 7 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

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 CTNNB1 4548/4885WNT3A 4001/4885PTPN1 462/4885

“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.