SCHEMBL493785

SCHEMBL493785

Cc1cc(Cl)cc(Cl)c1-c1noc(C(=O)NCC(=O)O)n1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.41
MAPT P10636 2/20 0.41
KDM4E B2RXH2 1/20 0.41
KMT2A Q03164 1/20 0.41
TP53 P04637 2/20 0.39
RXFP1 Q9HBX9 1/20 0.39
EGLN1 Q9GZT9 2/20 0.38
GSK3B P49841 1/20 0.38
VEGFA P15692 1/20 0.38
FLT1 P17948 1/20 0.38
RAB9A P51151 1/20 0.37
LMNA P02545 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
GLA P06280 1/20 0.37
PKM P14618 1/20 0.37

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
SCHEMBL493401 0.85 ALDH1A1 (0.42) KMT2AGSK3BRAB9ALMNASMN1; SMN2
SCHEMBL493603 0.82 KMT2A (0.44) MAPTKDM4EKMT2ATP53RXFP1
SCHEMBL493270 0.82 TPMT (0.39) TP53RXFP1RAB9ASMN1; SMN2
SCHEMBL492888 0.81 SHMT1 (0.48) CYP2C19MAPTKDM4EKMT2ARXFP1
SCHEMBL493024 0.80 CYP2C19 (0.47) CYP2C19MAPTKDM4EKMT2AEGLN1
SCHEMBL493104 0.74 POLB (0.46) KMT2AEGLN1GSK3BVEGFAFLT1
SCHEMBL493223 0.74 RAB9A (0.38) MAPTKDM4EKMT2ARAB9A
SCHEMBL493438 0.71 KMT2A (0.67) MAPTKDM4EKMT2A
SCHEMBL493476 0.70 FABP4 (0.48) MAPTKDM4EKMT2AGSK3BRAB9A
SCHEMBL493052 0.69 KDM4E (0.73) CYP2C19MAPTKDM4EKMT2ATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8106055-B2 Substituted amide compounds GRUENENTHAL GMBH (DE) 2012-01-31 US disclosed
US-20080306084-A1 Substituted Amide Compounds GRUENENTHAL GMBH (DE) 2008-12-11 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-20080306084-A1 Substituted Amide Compounds OPRK1, NAA50, ACMSD CYP2C19 134/4885MAPT 1653/4885KDM4E 2178/4885

“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.