SCHEMBL4777034

SCHEMBL4777034

O=C(O)c1ccc(-c2ccc(F)c(Cl)c2)cn1

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMO O15229 5/20 0.61
HSD17B1 P14061 2/20 0.56
HSD17B2 P37059 2/20 0.56
MAP4K4 O95819 1/20 0.55
MARS1 P56192 1/20 0.50
RPA1 P27694 1/20 0.49
GCGR P47871 1/20 0.47
HSD17B14 Q9BPX1 2/20 0.47
PTGS2 P35354 1/20 0.45
CHRNA7 P36544 1/20 0.45
EGLN1 Q9GZT9 1/20 0.44
GRIN2B Q13224 4/20 0.44
GRIN1 Q05586 2/20 0.44
KDM4E B2RXH2 1/20 0.44
ASPH Q12797 1/20 0.44
KDM8 Q8N371 1/20 0.44

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
SCHEMBL4780344 0.88 KMO (0.61) KMOHSD17B1HSD17B2MAP4K4GCGR
SCHEMBL4780370 0.85 KMO (0.68) KMOHSD17B1HSD17B2MAP4K4PTGS2
SCHEMBL4725410 0.80 MAP4K4 (0.68) KMOMAP4K4RPA1PTGS2EGLN1
SCHEMBL21552113 0.79 EGLN1 (0.58) KMOMAP4K4GCGRPTGS2EGLN1
SCHEMBL13731115 0.79 P4HTM (0.64) MAP4K4EGLN1KDM4E
SCHEMBL11044929 0.79 MAP4K4 (0.55) KMOHSD17B1HSD17B2MAP4K4RPA1
SCHEMBL486067 0.78 KMO (0.59) KMOMAP4K4EGLN1KDM4E
SCHEMBL29928830 0.76 P4HTM (0.57) MAP4K4EGLN1KDM4EASPHKDM8
SCHEMBL2636731 0.76 P4HTM (0.57) MAP4K4EGLN1KDM4EASPHKDM8
SCHEMBL4781819 0.76 MAP4K4 (0.59) MAP4K4MARS1GCGRPTGS2

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
WO-2008001160-A1 MELANIN CONCENTRATING HORMONE ANTAGONISTS THE PROCTER & GAMBLE COMPANY (US) 2008-01-03 WO claimed
US-20060247239-A1 Melanin concentrating hormone antagonists HU XIUFENG E 2006-11-02 US claimed
WO-2008001160-A1 MELANIN CONCENTRATING HORMONE ANTAGONISTS THE PROCTER & GAMBLE COMPANY (US) 2008-01-03 WO disclosed
US-20060247239-A1 Melanin concentrating hormone antagonists HU XIUFENG E 2006-11-02 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-20060247239-A1 Melanin concentrating hormone antagonists MCHR1, MCHR2, MC1R KMO 360/4885HSD17B1 339/4885HSD17B2 229/4885

“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.