SCHEMBL7035832

SCHEMBL7035832

Nc1ccc(N2CCC2C(=O)O)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GFER P55789 4/20 0.41
CASP6 P55212 1/20 0.41
HTT P42858 3/20 0.37
BRS3 P32247 1/20 0.37
ALDH1A1 P00352 5/20 0.36
MAPT P10636 5/20 0.36
GAA P10253 4/20 0.36
KDM4E B2RXH2 2/20 0.36
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
NPC1 O15118 1/20 0.36
USP2 O75604 1/20 0.36
TP53 P04637 1/20 0.36
POLB P06746 1/20 0.36
THRB P10828 1/20 0.36
ALOX15 P16050 1/20 0.36
RECQL P46063 1/20 0.36
RAB9A P51151 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
HSD17B10 Q99714 1/20 0.36

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
SCHEMBL13015198 1.00 GFER (0.41) GFERCASP6HTTBRS3ALDH1A1
SCHEMBL4715449 0.90 SMN1; SMN2 (0.44) GFERCASP6BRS3ALDH1A1MAPT
SCHEMBL7029894 0.86 SYK (0.44) GFERCASP6HTTALDH1A1MAPT
SCHEMBL5702089 0.83 NOTUM (0.49) ALDH1A1KMT2AMEN1NOTUMSIGMAR1
SCHEMBL5702158 0.83 NOTUM (0.49) ALDH1A1KMT2AMEN1NOTUMSIGMAR1
SCHEMBL20458161 0.82 NOTUM (0.53) ALDH1A1MAPTGAAKDM4EKMT2A
SCHEMBL2121761 0.82 NOTUM (0.53) GFERHTTALDH1A1MAPTKMT2A
SCHEMBL9891645 0.82 NOTUM (0.53) ALDH1A1MAPTGAAKDM4EKMT2A
SCHEMBL2121764 0.82 NOTUM (0.53) GFERHTTALDH1A1MAPTKMT2A
SCHEMBL27634306 0.79 FKBP1A (0.40) GFERCASP6HTTALDH1A1MAPT

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-20030028976-A1 Compositions for dyeing keratinic fibres, containing paraphenylenediamine derivatives with an azetidinyl group L'OREAL S.A. (FR) 2003-02-13 US claimed
US-20030028976-A1 Compositions for dyeing keratinic fibres, containing paraphenylenediamine derivatives with an azetidinyl group L'OREAL S.A. (FR) 2003-02-13 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-20030028976-A1 Compositions for dyeing keratinic fibres, containing paraphenylenediamine derivatives with an azetidinyl group KRT18, CDC73, AOC1 GFER 1850/4885CASP6 2908/4885HTT 3226/4885

“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.