SCHEMBL2812294

SCHEMBL2812294

CCc1ccc(NC(=O)Nc2[nH]c(COc3ccc(CC(=O)O)cc3)nc2C(N)=O)cc1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.48
POLB P06746 1/20 0.48
KMT2A Q03164 7/20 0.43
MEN1 O00255 6/20 0.43
NOX1 Q9Y5S8 2/20 0.41
PKM P14618 1/20 0.41
RAB9A P51151 3/20 0.40
GBA1 P04062 1/20 0.40
FFAR1 O14842 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
LMNA P02545 1/20 0.40
MAPT P10636 2/20 0.40
PABPC1 P11940 1/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA9 Q16790 1/20 0.39
NPC1 O15118 2/20 0.38
MGAM O43451 1/20 0.38

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
SCHEMBL2816636 0.90 KDM4E (0.46) KDM4EPOLBKMT2AMEN1GBA1
SCHEMBL2817001 0.90 KDM4E (0.46) KDM4EPOLBKMT2AMEN1NOX1
SCHEMBL3989813 0.89 POLB (0.45) KDM4EPOLBKMT2AMEN1NOX1
SCHEMBL2816392 0.88 KDM4E (0.51) KDM4EPOLBKMT2AMEN1GBA1
SCHEMBL2815448 0.88 PPARD (0.46) KDM4EPOLB
SCHEMBL2815561 0.85 MAPT (0.44) KDM4EPOLBKMT2AMEN1PKM
SCHEMBL2816222 0.83 CDK8 (0.47) KDM4EPOLB
SCHEMBL3998867 0.83 PLA2G4B (0.42) KDM4EKMT2AMEN1LMNAMAPT
SCHEMBL2819406 0.83 L3MBTL1 (0.42) KDM4EPOLBKMT2AMEN1RAB9A
SCHEMBL2816973 0.81 ALOX5 (0.41) KDM4EPOLBFFAR1MAPT

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
EP-2193122-B1 IMIDAZOLE DERIVATIVES MERCK PATENT GMBH (DE) 2016-08-03 EP claimed
US-20100249132-A1 IMIDAZOLE DERIVATIVES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2010-09-30 US claimed
EP-2193122-B1 IMIDAZOLE DERIVATIVES MERCK PATENT GMBH (DE) 2016-08-03 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-20100249132-A1 IMIDAZOLE DERIVATIVES SDHA, SDHB, TPD52L2 KDM4E 506/4885POLB 2686/4885KMT2A 1034/4885

“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.