SCHEMBL1537559

SCHEMBL1537559

COC(=O)c1cc(C(=O)O)cc(-c2ccc(C=O)cc2)c1

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.60
ERN1 O75460 8/20 0.48
TRIM24 O15164 1/20 0.45
TRIM33 Q9UPN9 1/20 0.45
RXRA P19793 2/20 0.44
DHODH Q02127 2/20 0.44
EGFR P00533 1/20 0.41
KDM4E B2RXH2 1/20 0.41
KDM6B O15054 1/20 0.41
KDM5C P41229 1/20 0.41
KDM4C Q9H3R0 1/20 0.41
KDM2A Q9Y2K7 1/20 0.41
KDM3A Q9Y4C1 1/20 0.41
TSHR P16473 1/20 0.41
RXRB P28702 1/20 0.41

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
SCHEMBL1537555 0.94 ALDH1A1 (0.68) ALDH1A1ERN1EGFRKDM4ETSHR
SCHEMBL15160947 0.84 ALDH1A1 (0.79) ALDH1A1ERN1EGFRTSHR
SCHEMBL15008457 0.84 RXRA (0.61) ERN1RXRAEGFRKDM4EKDM6B
SCHEMBL14577650 0.84 ALDH1A1 (0.56) ALDH1A1ERN1KDM4EKDM6BKDM5C
SCHEMBL1495508 0.83 DHODH (0.57) ALDH1A1RXRADHODHEGFRKDM4E
SCHEMBL3049378 0.82 DHODH (0.59) DHODHEGFRTSHR
SCHEMBL2389679 0.82 ALDH1A1 (0.89) ALDH1A1ERN1EGFRTSHR
SCHEMBL2561821 0.82 RXRA (0.64) ALDH1A1ERN1TRIM24TRIM33RXRA
SCHEMBL184501 0.81 KDM4E (0.55) ERN1RXRADHODHEGFRKDM4E
SCHEMBL10068712 0.80 ALDH1A1 (0.53) ALDH1A1ERN1TRIM24TRIM33EGFR

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-20110064694-A1 ANTI-HEPATITIS C ACTIVITY OF MESO-TETRAKIS-PORPHYRIN ANALOGUES YALE UNIVERSITY (US) 2011-03-17 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-20110064694-A1 ANTI-HEPATITIS C ACTIVITY OF MESO-TETRAKIS-PORPHYRIN ANALOGUES HAVCR2, HCCS, HMBS ALDH1A1 3535/4885ERN1 3075/4885TRIM24 1222/4885

“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.