SCHEMBL17368403

SCHEMBL17368403

Cc1ccc(NC(=O)C(C)CN)cc1

nearest known ligand 0.61

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.61
▸ POLB P06746 2/20 0.53
▸ CA1 P00915 3/20 0.50
▸ CA2 P00918 3/20 0.50
▸ ALDH1A1 P00352 2/20 0.50
▸ CA7 P43166 2/20 0.50
▸ CA14 Q9ULX7 2/20 0.50
▸ TDP1 Q9NUW8 1/20 0.50
▸ CA12 O43570 1/20 0.50
▸ CA9 Q16790 1/20 0.50
▸ HSD17B10 Q99714 1/20 0.50
▸ LMNA P02545 1/20 0.49
▸ HTT P42858 1/20 0.49
▸ KIF11 P52732 1/20 0.49
▸ KDM4E B2RXH2 1/20 0.49
▸ NPC1 O15118 1/20 0.47
▸ RAB9A P51151 1/20 0.47

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
SCHEMBL12125174 0.84 CA1 (0.64) MAPTPOLBCA1CA2ALDH1A1
SCHEMBL28717992 0.82 MAPT (0.56) MAPTPOLBCA1CA2ALDH1A1
SCHEMBL29410408 0.82 MAPT (0.56) MAPTPOLBCA1CA2ALDH1A1
SCHEMBL26503435 0.82 MAPT (0.61) MAPTPOLBCA1CA2ALDH1A1
SCHEMBL7702751 0.81 HSD17B10 (0.69) MAPTPOLBCA1CA2ALDH1A1
SCHEMBL10797653 0.80 CA1 (0.60) CA1CA2CA7CA14CA12
SCHEMBL12997450 0.79 MAPT (0.67) MAPTPOLBCA1CA2ALDH1A1
SCHEMBL10975281 0.79 MAPT (0.67) MAPTPOLBCA1CA2ALDH1A1
SCHEMBL178429 0.79 MAPT (0.71) MAPTPOLBCA1CA2ALDH1A1
SCHEMBL5037047 0.78 MAPT (0.56) MAPTPOLBCA1CA2ALDH1A1

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-20150376120-A1 ALBICIDIN DERIVATIVES, THEIR USE AND SYNTHESIS Technische Universität Berlin (DE) 2015-12-31 — — 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-20150376120-A1 ALBICIDIN DERIVATIVES, THEIR USE AND SYNTHESIS MB, ALB, BCAT2 MAPT 3111/4885POLB 305/4885CA1 3142/4885

“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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