SCHEMBL5422835

SCHEMBL5422835

CC(C)OCCCN(CCCC(=O)c1ccc2c(c1)CCNCC2)C(=O)C(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 5/20 0.41
ACHE P22303 1/20 0.39
HRH3 Q9Y5N1 1/20 0.39
SLC6A4 P31645 2/20 0.34
SLC6A2 P23975 1/20 0.34
MELK Q14680 1/20 0.34
CTNNB1 P35222 1/20 0.33
WNT3A P56704 1/20 0.33
THRA P10827 1/20 0.32
THRB P10828 1/20 0.32
MLNR O43193 1/20 0.32

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
SCHEMBL5422848 0.88 MCHR1 (0.43) MCHR1ACHEHRH3SLC6A4MELK
SCHEMBL5453442 0.87 MCHR1 (0.45) MCHR1ACHETHRATHRBMLNR
SCHEMBL5431961 0.86 MCHR1 (0.44) MCHR1ACHEHRH3SLC6A4MELK
SCHEMBL5418562 0.86 HRH3 (0.45) MCHR1ACHEHRH3SLC6A4CTNNB1
SCHEMBL5421012 0.84 MCHR1 (0.43) MCHR1ACHEHRH3SLC6A4MELK
SCHEMBL5428817 0.82 MCHR1 (0.43) MCHR1ACHEHRH3SLC6A4MELK
SCHEMBL5420452 0.82 ACHE (0.52) MCHR1ACHETHRATHRB
SCHEMBL5418939 0.82 MCHR1 (0.54) MCHR1ACHE
SCHEMBL5423753 0.82 MCHR1 (0.47) MCHR1ACHECTNNB1WNT3A
SCHEMBL5429436 0.81 MCHR1 (0.43) MCHR1ACHEHRH3SLC6A4MELK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7229986-B2 Melanin-concentrating hormone antagonist TAKEDA PHARMACEUTICAL COMPANY LTD. (JP) 2007-06-12 US disclosed
US-20030158177-A1 Treating or preventing obesity TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2003-08-21 US disclosed
EP-1283199-A1 MELANIN-CONCENTRATING HORMONE ANTAGONIST Takeda Chemical Industries, Ltd. (JP) 2003-02-12 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-20030158177-A1 Treating or preventing obesity MCHR1, MC1R, NPY1R MCHR1 1/4885ACHE 4544/4885HRH3 196/4885

“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.