SCHEMBL3144125

SCHEMBL3144125

Nc1ccc(CNC(=O)[C@H](Cc2ccc(Cl)c(Cl)c2)NC(=O)C(N)CC2CCCCC2)cn1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CPB2 Q96IY4 7/20 0.43
▸ MMP1 P03956 2/20 0.43
▸ FCER2 P06734 2/20 0.43
▸ KLKB1 P03952 3/20 0.42
▸ F2R P25116 1/20 0.42
▸ KLK1 P06870 1/20 0.42
▸ MASP2 O00187 1/20 0.40
▸ METAP2 P50579 1/20 0.40
▸ METAP1 P53582 1/20 0.40
▸ F12 P00748 1/20 0.38
▸ F2 P00734 1/20 0.38
▸ F2RL1 P55085 2/20 0.38
▸ EPHX2 P34913 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
SCHEMBL1431835 1.00 CPB2 (0.43) CPB2MMP1FCER2KLKB1F2R
SCHEMBL15901636 0.86 KLKB1 (0.56) CPB2MMP1FCER2KLKB1F2R
SCHEMBL14485428 0.86 KLKB1 (0.56) CPB2MMP1FCER2KLKB1F2R
SCHEMBL3155821 0.85 F2 (0.55) F2RMASP2F2
SCHEMBL3155827 0.85 F2 (0.55) F2RMASP2F2
SCHEMBL3149376 0.84 MASP2 (0.43) KLKB1KLK1MASP2EPHX2
SCHEMBL1431486 0.84 MASP2 (0.43) KLKB1KLK1MASP2EPHX2
SCHEMBL3154833 0.84 MASP2 (0.48) CPB2MASP2METAP2METAP1F2
SCHEMBL1431700 0.84 KLKB1 (0.49) MMP1FCER2KLKB1KLK1MASP2
SCHEMBL3153048 0.84 KLKB1 (0.49) MMP1FCER2KLKB1KLK1MASP2

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-20100076015-A1 Aminopyridine Derivatives VANTIA LIMITED (GB) 2010-03-25 — — 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-20100076015-A1 Aminopyridine Derivatives CHRM1, ARG1, ARG2 CPB2 2005/4885MMP1 2614/4885FCER2 2434/4885

“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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