SCHEMBL14073612

SCHEMBL14073612

NC(=O)NCC(=O)Nc1ccc2c(c1)NC(=O)CO2

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.58
▸ ALDH1A1 P00352 4/20 0.58
▸ KMT2A Q03164 3/20 0.56
▸ F7 P08709 2/20 0.53
▸ F2 P00734 1/20 0.53
▸ POLB P06746 1/20 0.52
▸ LMNA P02545 1/20 0.50
▸ TRPV1 Q8NER1 10/20 0.49
▸ MEN1 O00255 1/20 0.48
▸ CYP1A2 P05177 1/20 0.48
▸ CYP2C9 P11712 1/20 0.48
▸ CYP2C19 P33261 1/20 0.48

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
SCHEMBL27652513 0.83 MAPT (0.62) MAPTALDH1A1KMT2APOLBLMNA
SCHEMBL4576855 0.83 ALDH1A1 (0.62) MAPTALDH1A1KMT2APOLBLMNA
SCHEMBL14073095 0.81 MAPT (0.60) MAPTALDH1A1KMT2APOLBLMNA
SCHEMBL14073718 0.79 TRPV1 (0.53) MAPTALDH1A1KMT2AF7F2
SCHEMBL14073622 0.77 POLB (0.59) MAPTALDH1A1KMT2APOLBLMNA
SCHEMBL8192718 0.76 ALDH1A1 (0.77) MAPTALDH1A1KMT2APOLBLMNA
SCHEMBL14073519 0.76 KMT2A (0.55) MAPTALDH1A1KMT2APOLBLMNA
SCHEMBL14073688 0.75 PARP1 (0.54) MAPTALDH1A1KMT2APOLBLMNA
SCHEMBL27981766 0.75 MAPT (0.62) MAPTALDH1A1KMT2APOLBLMNA
SCHEMBL3588732 0.75 MAPT (0.62) MAPTALDH1A1KMT2APOLBTRPV1

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-20080221093-A1 Metalloprotease inhibitors containing a heterocyclic moiety ALANTOS PHARMACEUTICALS HOLDING, INC. 2008-09-11 — — US disclosed
US-20080221093-A1 Metalloprotease inhibitors containing a heterocyclic moiety ALANTOS PHARMACEUTICALS HOLDING, INC. 2008-09-11 — — 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-20080221093-A1 Metalloprotease inhibitors containing a heterocyclic moiety MMP12, MMP13, MMP25 MAPT 3986/4885ALDH1A1 714/4885KMT2A 2900/4885

“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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