SCHEMBL14073622

SCHEMBL14073622

O=C(CC12CC3CC(CC(C3)C1)C2)Nc1ccc2c(c1)NC(=O)CO2

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.59
▸ NPSR1 Q6W5P4 1/20 0.59
▸ ALDH1A1 P00352 2/20 0.56
▸ MAPT P10636 2/20 0.56
▸ P2RX7 Q99572 3/20 0.54
▸ KMT2A Q03164 2/20 0.54
▸ TRPV1 Q8NER1 8/20 0.50
▸ LMNA P02545 1/20 0.48
▸ GPR55 Q9Y2T6 1/20 0.48
▸ CA12 O43570 1/20 0.48
▸ CA9 Q16790 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
SCHEMBL14073896 0.91 POLB (0.59) POLBNPSR1ALDH1A1MAPTP2RX7
SCHEMBL14073616 0.84 MAPT (0.58) POLBALDH1A1MAPTKMT2ATRPV1
SCHEMBL14073372 0.84 KMT2A (0.54) POLBALDH1A1MAPTKMT2A
SCHEMBL4576855 0.81 ALDH1A1 (0.62) POLBALDH1A1MAPTKMT2ATRPV1
SCHEMBL27652513 0.81 MAPT (0.62) POLBALDH1A1MAPTKMT2ATRPV1
SCHEMBL14073095 0.79 MAPT (0.60) POLBALDH1A1MAPTKMT2ATRPV1
SCHEMBL14072971 0.77 GAA (0.61) POLBALDH1A1MAPTP2RX7LMNA
SCHEMBL14073071 0.77 PARP1 (0.50) POLBALDH1A1MAPTKMT2A
SCHEMBL14073612 0.77 MAPT (0.58) POLBALDH1A1MAPTKMT2ATRPV1
SCHEMBL14073510 0.76 MAPT (0.56) POLBALDH1A1MAPTKMT2ATRPV1

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-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 POLB 2906/4885NPSR1 1482/4885ALDH1A1 714/4885

“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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