SCHEMBL14073587

SCHEMBL14073587

O=C1COc2ccc(NC(=O)c3cccc4[nH]ccc34)cc2N1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.67
▸ ALDH1A1 P00352 3/20 0.52
▸ MAPT P10636 2/20 0.52
▸ DHPS P49366 1/20 0.51
▸ ADRB2 P07550 2/20 0.49
▸ HTR1A P08908 2/20 0.49
▸ SLC6A4 P31645 2/20 0.49
▸ POLB P06746 1/20 0.49
▸ GRM5 P41594 1/20 0.49
▸ MALT1 Q9UDY8 1/20 0.49
▸ TRPV1 Q8NER1 7/20 0.47
▸ CYP3A4 P08684 1/20 0.47
▸ CYP2C9 P11712 2/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ CYP1A2 P05177 1/20 0.46
▸ CYP2C19 P33261 1/20 0.46
▸ CFTR P13569 1/20 0.45
▸ GABRA1 P14867 1/20 0.45
▸ GABRB1 P18505 1/20 0.45
▸ GABRA5 P31644 1/20 0.45

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
SCHEMBL14073821 0.92 KMT2A (0.55) KMT2AALDH1A1MAPTDHPSADRB2
SCHEMBL14073538 0.86 KMT2A (0.68) KMT2AALDH1A1MAPTPOLBMALT1
SCHEMBL14073326 0.83 TSHR (0.55) KMT2AALDH1A1ADRB2HTR1ASLC6A4
SCHEMBL14073640 0.79 ALDH1A1 (0.61) KMT2AALDH1A1MAPTPOLBTRPV1
SCHEMBL14073502 0.78 KMT2A (0.65) KMT2AALDH1A1MAPTPOLBTRPV1
SCHEMBL14073754 0.78 KMT2A (0.56) KMT2ATRPV1CYP3A4CYP2C9MEN1
SCHEMBL14073544 0.78 MAPT (0.60) KMT2AALDH1A1MAPTPOLBTRPV1
SCHEMBL14073610 0.77 KMT2A (0.67) KMT2AALDH1A1MAPTHTR1ASLC6A4
SCHEMBL14073592 0.77 KMT2A (0.69) KMT2AALDH1A1MAPTPOLBGRM5
SCHEMBL14073580 0.76 KMT2A (0.66) KMT2AALDH1A1MAPTHTR1APOLB

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 KMT2A 2900/4885ALDH1A1 714/4885MAPT 3986/4885

“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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