SCHEMBL5582789

SCHEMBL5582789

CC(=O)Nc1ccc2c(c1)CCC(CCN1CCCC1)=C2

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 10/20 0.56
HTR2C P28335 1/20 0.53
KDM4E B2RXH2 1/20 0.45
ALDH1A1 P00352 1/20 0.45
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL5582516 0.83 MCHR1 (0.48) MCHR1HTR2CNPC1RAB9A
SCHEMBL5583091 0.82 MCHR1 (0.81) MCHR1HTR2C
SCHEMBL5582595 0.81 MCHR1 (0.82) MCHR1HTR2C
SCHEMBL5582835 0.81 MCHR1 (0.82) MCHR1HTR2CNPC1RAB9ASMN1; SMN2
SCHEMBL5582526 0.80 MCHR1 (0.49) MCHR1HTR2CNPC1RAB9A
SCHEMBL5582597 0.80 MCHR1 (0.54) MCHR1HTR2CKDM4ENPC1RAB9A
SCHEMBL14454771 0.78 MCHR1 (0.49) MCHR1HTR2CNPC1RAB9A
SCHEMBL8531503 0.72 HTR2A (0.41) MCHR1HTR2C
SCHEMBL8535840 0.72 ALDH1A1 (0.46) MCHR1HTR2CKDM4EALDH1A1NPC1
SCHEMBL5583039 0.72 MCHR1 (0.77) MCHR1HTR2CNPC1RAB9AKMT2A

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
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

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 195/4885KDM4E 2952/4885

“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.