SCHEMBL4317581

SCHEMBL4317581

Cc1c(CN2CCCC2)nc2ccc(NC(=O)c3ccc(C=Cc4ccccc4)cc3)cn12

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 12/20 0.45
MAPK1 P28482 1/20 0.44
HTR2C P28335 3/20 0.42
TNF P01375 1/20 0.40
HDAC1 Q13547 1/20 0.40
HIF1A Q16665 1/20 0.40
EPAS1 Q99814 1/20 0.40
ALDH1A1 P00352 2/20 0.40
TRPV1 Q8NER1 1/20 0.40
KDM4E B2RXH2 1/20 0.40
MAPT P10636 1/20 0.40
RAB9A P51151 1/20 0.40
ABL1 P00519 1/20 0.39
BCR P11274 1/20 0.39

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
SCHEMBL4317578 1.00 MCHR1 (0.45) MCHR1MAPK1HTR2CTNFHDAC1
SCHEMBL4313305 0.86 MCHR1 (0.46) MCHR1HDAC1ALDH1A1KDM4ERAB9A
SCHEMBL4313307 0.86 MCHR1 (0.46) MCHR1HDAC1ALDH1A1KDM4ERAB9A
SCHEMBL13783559 0.84 NPC1 (0.50) MAPK1KDM4EMAPTRAB9A
SCHEMBL4317670 0.82 MCHR1 (0.46) MCHR1MAPK1TRPV1KDM4ERAB9A
SCHEMBL4317666 0.82 MCHR1 (0.46) MCHR1MAPK1TRPV1KDM4ERAB9A
SCHEMBL4317648 0.80 KDM4E (0.52) MCHR1ALDH1A1KDM4EMAPTRAB9A
SCHEMBL4329790 0.77 TGFBR1 (0.48) MCHR1ALDH1A1RAB9A
SCHEMBL4329782 0.77 TGFBR1 (0.48) MCHR1ALDH1A1RAB9A
SCHEMBL4310424 0.75 MCHR1 (0.48) MCHR1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7566781-B2 Imidazopyridine compound BANYU PHARMACEUTICAL CO., LTD. (JP) 2009-07-28 US disclosed
US-20070249659-A1 melanin concentrating hormone receptor antagonist; preventing or treating vascular system diseases, nervous system disorders, metabolic disorders, urogenital diseases, respiratory diseases disorders; N-(2-ethyl-3-methylimidazo[1,2-a]pyridin-6-yl)-3-fluoro-4-(pyridin-2-ylmethoxy)benzamide BANYU PHARMACEUTICAL., LTD. (JP) 2007-10-25 US disclosed
EP-1748048-A1 IMIDAZOPYRIDINE COMPOUND BANYU PHARMACEUTICAL CO., LTD. (JP) 2007-01-31 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-20070249659-A1 melanin concentrating hormone receptor antagonist; preventing or treating vascular system diseases, nervous system disorders, metabolic disorders, urogenital diseases, respiratory diseases disorders; N-(2-ethyl-3-methylimidazo[1,2-a]pyridin-6-yl)-3-fluoro-4-(pyridin-2-ylmethoxy)benzamide MC1R, MCHR2, MCHR1 MCHR1 3/4885MAPK1 1299/4885HTR2C 29/4885

“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.