SCHEMBL5582567

SCHEMBL5582567

COc1ccc(C2CCN(C(=O)Nc3ccc4c(c3)CCC(CN3CCCC3)=C4C)CC2)cc1

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 6/20 0.59
HTR2C P28335 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.45
MAPT P10636 5/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
CHRM4 P08173 1/20 0.44
TP53 P04637 2/20 0.43
FAAH O00519 2/20 0.42
FASN P49327 1/20 0.42
LMNA P02545 1/20 0.42
THRB P10828 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
SCHEMBL5582565 0.94 MCHR1 (0.53) MCHR1SMN1; SMN2MAPTMEN1KMT2A
SCHEMBL5582668 0.91 MCHR1 (0.59) MCHR1HTR2CSMN1; SMN2MAPTTP53
SCHEMBL5583037 0.90 MCHR1 (0.57) MCHR1HTR2CSMN1; SMN2MAPTKMT2A
SCHEMBL5582484 0.86 MCHR1 (0.59) MCHR1HTR2CSMN1; SMN2MAPTMEN1
SCHEMBL5582880 0.85 MCHR1 (0.51) MCHR1HTR2CSMN1; SMN2MAPTTP53
SCHEMBL5582573 0.84 MCHR1 (0.50) MCHR1HTR2CSMN1; SMN2MAPTCHRM4
SCHEMBL5582844 0.82 MCHR1 (0.67) MCHR1HTR2CSMN1; SMN2MAPTCHRM4
SCHEMBL5583099 0.81 MCHR1 (0.67) MCHR1HTR2CMAPTKMT2ALMNA
SCHEMBL2920670 0.79 MCHR1 (0.79) MCHR1HTR2CSMN1; SMN2MEN1KMT2A
SCHEMBL5583094 0.76 MCHR1 (0.59) MCHR1HTR2CSMN1; SMN2MAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7115750-B1 Melanin concentrating hormone antagonist TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-10-03 US claimed
EP-1218336-A2 MELANIN CONCENTRATING HORMONE ANTAGONIST Takeda Chemical Industries, Ltd. (JP) 2002-07-03 EP claimed
WO-2001021577-A2 MELANIN CONCENTRATING HORMONE ANTAGONIST TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-03-29 WO claimed
US-20070173498-A1 Melanin concentrating hormone antagonist KATO KANEYOSHI 2007-07-26 US disclosed
US-20070173498-A1 Melanin concentrating hormone antagonist KATO KANEYOSHI 2007-07-26 US disclosed
US-20070173498-A1 Melanin concentrating hormone antagonist KATO KANEYOSHI 2007-07-26 US disclosed
US-7115750-B1 Melanin concentrating hormone antagonist TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-10-03 US disclosed
EP-1218336-A2 MELANIN CONCENTRATING HORMONE ANTAGONIST Takeda Chemical Industries, Ltd. (JP) 2002-07-03 EP disclosed
WO-2001021577-A2 MELANIN CONCENTRATING HORMONE ANTAGONIST TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-03-29 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-20070173498-A1 Melanin concentrating hormone antagonist MC1R, MCHR1, MCHR2 MCHR1 2/4885HTR2C 195/4885SMN1; SMN2 3652/4885

“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.