SCHEMBL5582838

SCHEMBL5582838

CN(C)CC1CCCc2cc(NC(=O)c3ccc(-c4ccc(F)cc4)cc3)ccc2C1

nearest known ligand 0.89

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 17/20 0.89
NPC1 O15118 3/20 0.58
RAB9A P51151 3/20 0.58
NFKB1 P19838 2/20 0.58
NFKB2 Q00653 2/20 0.58
RELA Q04206 2/20 0.58
SMN1; SMN2 Q16637 2/20 0.58
TP53 P04637 1/20 0.58
ALDH1A1 P00352 1/20 0.47
MAPT P10636 1/20 0.47
HTR2C P28335 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
SCHEMBL5582818 0.94 MCHR1 (1.00) MCHR1NPC1RAB9ANFKB1NFKB2
SCHEMBL2669493 0.94 MCHR1 (1.00) MCHR1NPC1RAB9ANFKB1NFKB2
SCHEMBL29391945 0.94 MCHR1 (1.00) MCHR1NPC1RAB9ANFKB1NFKB2
Hydrochloric Acid SCHEMBL5582925 0.93 MCHR1 (0.98) MCHR1NPC1RAB9ANFKB1NFKB2
SCHEMBL5582975 0.90 MCHR1 (0.89) MCHR1
SCHEMBL5770522 0.85 MCHR1 (0.82) MCHR1NPC1RAB9ANFKB1NFKB2
SCHEMBL5582618 0.85 MCHR1 (0.85) MCHR1
SCHEMBL14454794 0.85 MCHR1 (1.00) MCHR1NPC1RAB9ANFKB1NFKB2
SCHEMBL5582601 0.85 MCHR1 (1.00) MCHR1
SCHEMBL14454784 0.85 MCHR1 (0.85) MCHR1

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 2/4885NPC1 1085/4885RAB9A 1813/4885

“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.