SCHEMBL2925557

SCHEMBL2925557

COc1ccc(C(=O)NC2CCN(c3ccc4cc(CN5[C@H](C)CCC[C@@H]5C)ccc4c3)CC2)cc1

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 3/20 0.60
MCHR1 Q99705 10/20 0.55
DRD4 P21917 2/20 0.55
KMT2A Q03164 2/20 0.49
MEN1 O00255 1/20 0.49
ALDH1A1 P00352 1/20 0.49
PKM P14618 1/20 0.49
CXCR4 P61073 1/20 0.48
CXCR6 O00574 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
SCHEMBL2925822 0.90 CCR3 (0.62) CCR3MCHR1
SCHEMBL2928190 0.77 MCHR1 (0.57) CCR3MCHR1PKM
SCHEMBL9594285 0.72 DRD4 (0.75) CCR3MCHR1DRD4
SCHEMBL3149781 0.72 CCR3 (0.72) CCR3MCHR1DRD4
SCHEMBL20167961 0.70 HRH3 (0.55) ALDH1A1
SCHEMBL3134114 0.70 MCHR1 (0.90) CCR3MCHR1DRD4
SCHEMBL13177425 0.69 MCHR1 (0.63) MCHR1KMT2AMEN1ALDH1A1
SCHEMBL678150 0.69 MCHR1 (1.00) MCHR1DRD4
SCHEMBL2536771 0.69 NPC1 (0.64) KMT2AMEN1
SCHEMBL9872559 0.69 DRD4 (0.78) CCR3MCHR1DRD4KMT2AMEN1

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 4 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
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 CCR3 1149/4885MCHR1 1/4885DRD4 249/4885

“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.