SCHEMBL2926522

SCHEMBL2926522

O=C(Nc1ccc2cc(CN3CCCCC3)ccc2c1)c1ccc(-c2ccc(Cl)cc2)cc1

nearest known ligand 0.78

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 15/20 0.78
HTR2C P28335 6/20 0.78
CHRM1 P11229 4/20 0.61
HTR2A P28223 4/20 0.61
CYP2D6 P10635 2/20 0.59
NPC1 O15118 1/20 0.58
RAB9A P51151 1/20 0.58
MLLT1 Q03111 1/20 0.58
CYP3A4 P08684 2/20 0.57
POLB P06746 1/20 0.57
GAA P10253 1/20 0.57
THRB P10828 1/20 0.57
CYP2C19 P33261 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
CYP2C9 P11712 1/20 0.57
TNF P01375 1/20 0.56

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
SCHEMBL2919360 0.99 MCHR1 (0.80) MCHR1HTR2CCHRM1HTR2ACYP2D6
SCHEMBL2921113 0.88 MCHR1 (0.80) MCHR1HTR2CCHRM1HTR2ACYP2D6
SCHEMBL2926180 0.87 MCHR1 (0.82) MCHR1HTR2CCHRM1HTR2ACYP2D6
SCHEMBL22079996 0.86 RAB9A (0.76) MCHR1HTR2CCHRM1HTR2ACYP2D6
SCHEMBL28663251 0.86 RAB9A (0.76) MCHR1HTR2CCHRM1HTR2ACYP2D6
SCHEMBL5647227 0.86 MCHR1 (0.98) MCHR1HTR2CCYP2D6MLLT1CYP3A4
SCHEMBL5648064 0.85 MCHR1 (1.00) MCHR1HTR2CCYP2D6MLLT1CYP3A4
SCHEMBL2925096 0.83 MCHR1 (0.80) MCHR1HTR2CCYP2D6MLLT1CYP3A4
SCHEMBL6306094 0.83 MCHR1 (0.58) MCHR1HTR2CNPC1RAB9A
SCHEMBL6313332 0.83 MCHR1 (0.71) MCHR1HTR2CNPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1285651-B1 MELANIN CONCENTRATING HORMONE ANTAGONISTS TAKEDA PHARMACEUTICAL (JP) 2010-09-01 EP disclosed
EP-1285651-B1 MELANIN CONCENTRATING HORMONE ANTAGONISTS TAKEDA PHARMACEUTICAL (JP) 2010-09-01 EP disclosed
US-6930185-B2 Melanin-concentrating hormone antagonist TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2005-08-16 US disclosed
US-20040077628-A1 Melanin-concentrating hormone antagonist TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-04-22 US disclosed
EP-1285651-A1 MELANIN CONCENTRATING HORMONE ANTAGONISTS Takeda Chemical Industries, Ltd. (JP) 2003-02-26 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-20040077628-A1 Melanin-concentrating hormone antagonist MCHR1, MC1R, MCHR2 MCHR1 1/4885HTR2C 107/4885CHRM1 656/4885

“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.