SCHEMBL5583039

SCHEMBL5583039

O=C(Nc1ccc2c(c1)CCC(CN1CCCC1)=C2)c1ccc(Br)cc1

nearest known ligand 0.77

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 13/20 0.77
HTR2C P28335 2/20 0.76
NPC1 O15118 1/20 0.49
MELK Q14680 1/20 0.49
USP2 O75604 1/20 0.49
KMT2A Q03164 1/20 0.49
TNF P01375 1/20 0.47
NOD2 Q9HC29 1/20 0.47
NOD1 Q9Y239 1/20 0.47
GAA P10253 1/20 0.47
HTT P42858 1/20 0.47
RAB9A P51151 1/20 0.47
TNIK Q9UKE5 1/20 0.46

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
SCHEMBL5582798 0.87 MCHR1 (1.00) MCHR1HTR2C
SCHEMBL5582658 0.86 MCHR1 (1.00) MCHR1HTR2CNPC1RAB9A
SCHEMBL5582498 0.86 MCHR1 (0.98) MCHR1HTR2C
SCHEMBL5582522 0.86 MCHR1 (1.00) MCHR1HTR2CNPC1RAB9A
SCHEMBL5582935 0.86 MCHR1 (1.00) MCHR1HTR2C
SCHEMBL5582620 0.85 MCHR1 (0.81) MCHR1HTR2C
SCHEMBL5582708 0.85 MCHR1 (1.00) MCHR1HTR2C
SCHEMBL5582560 0.85 MCHR1 (0.98) MCHR1HTR2CNPC1RAB9A
SCHEMBL5582932 0.84 MCHR1 (1.00) MCHR1HTR2CKMT2A
SCHEMBL5582582 0.83 MCHR1 (0.79) MCHR1HTR2C

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 195/4885NPC1 1085/4885

“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.