SCHEMBL493476

SCHEMBL493476

O=C(O)CCNC(=O)c1nc(-c2cc(Cl)cc(Cl)c2)no1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FABP4 P15090 1/20 0.48
TSHR P16473 2/20 0.43
GSK3B P49841 2/20 0.43
KDM4E B2RXH2 1/20 0.43
MAPT P10636 1/20 0.43
KMT2A Q03164 1/20 0.43
GCGR P47871 3/20 0.42
GIPR P48546 1/20 0.42
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL493603 0.87 KMT2A (0.44) TSHRGSK3BKDM4EMAPTKMT2A
SCHEMBL30497244 0.81 FABP4 (0.50) FABP4GCGRGIPR
SCHEMBL25295021 0.81 FABP4 (0.50) FABP4GCGRGIPR
SCHEMBL493217 0.81 GCGR (0.49) GSK3BGCGR
SCHEMBL493923 0.78 KMT2A (0.65) KDM4EMAPTKMT2A
SCHEMBL494418 0.77 TPMT (0.48) TSHRNPC1RAB9A
SCHEMBL493533 0.76 NPC1 (0.51) TSHRMAPTKMT2ANPC1RAB9A
SCHEMBL19380053 0.73 MAOB (0.56) TSHRKDM4EKMT2ASMN1; SMN2
SCHEMBL493896 0.72 FAAH (0.56) TSHRKDM4EMAPTKMT2ANPC1
SCHEMBL493260 0.72 SMN1; SMN2 (0.75) MAPTKMT2ANPC1RAB9ASMN1; SMN2

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 FABP4 300/4885TSHR 4051/4885GSK3B 3830/4885

“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.