SCHEMBL6645706

SCHEMBL6645706

Cc1ccc(C(=O)Nc2ccc3c(c2)CCN(Cc2ncn(C(c4ccccc4)(c4ccccc4)c4ccccc4)n2)C3)c(N(C)C)n1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ NOD1 Q9Y239 5/20 0.38
▸ TNF P01375 3/20 0.38
▸ NOD2 Q9HC29 3/20 0.38
▸ PLAU P00749 1/20 0.38
▸ KDR P35968 3/20 0.37
▸ MEN1 O00255 4/20 0.37
▸ KMT2A Q03164 4/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ LMNA P02545 1/20 0.36
▸ ITGB3 P05106 1/20 0.35
▸ ITGA2B P08514 1/20 0.35
▸ KDM4E B2RXH2 2/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ TMPRSS2 O15393 1/20 0.35
▸ RAB9A P51151 2/20 0.34
▸ GFER P55789 1/20 0.34
▸ NPC1 O15118 1/20 0.34

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
SCHEMBL6643995 0.88 NOD1 (0.41) NOD1TNFNOD2PLAUKDR
SCHEMBL6648871 0.86 SCN10A (0.37) NOD1PLAUKDRMEN1KMT2A
SCHEMBL6645494 0.82 NOD1 (0.39) NOD1TNFNOD2PLAUKDR
SCHEMBL6648162 0.81 PLAU (0.42) NOD1TNFNOD2PLAUMEN1
SCHEMBL6490283 0.75 NOD1 (0.39) NOD1TNFNOD2KDRMEN1
SCHEMBL6649475 0.75 TMPRSS2 (0.47) MEN1KMT2ASMN1; SMN2KDM4ETMPRSS2
SCHEMBL6647429 0.69 NOD1 (0.45) NOD1TNFNOD2PLAUMEN1
SCHEMBL6644871 0.67 F2 (0.50) PLAUMEN1KMT2A
SCHEMBL6644698 0.66 EIF2AK3 (0.44) SMN1; SMN2LMNARAB9ANPC1
SCHEMBL6644942 0.66 PLAU (0.40) NOD1PLAUMEN1KMT2ASMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040133008-A1 Amide compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-07-08 — — 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-20040133008-A1 Amide compounds APOB, APOL1, LDLR NOD1 850/4885TNF 3852/4885NOD2 1085/4885

“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.

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