SCHEMBL25410705

SCHEMBL25410705

O=C(CCNC(=O)c1ccc(O)c(O)c1O)NO

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.50
HDAC1 Q13547 11/20 0.44
HDAC2 Q92769 8/20 0.44
HDAC3 O15379 7/20 0.44
HDAC4 P56524 7/20 0.44
HDAC7 Q8WUI4 7/20 0.44
HDAC10 Q969S8 7/20 0.44
HDAC11 Q96DB2 7/20 0.44
HDAC8 Q9BY41 7/20 0.44
HDAC6 Q9UBN7 7/20 0.44
HDAC9 Q9UKV0 7/20 0.44
HDAC5 Q9UQL6 7/20 0.44
SELL P14151 1/20 0.44
SELP P16109 1/20 0.44
DNM2 P50570 2/20 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
SCHEMBL25434571 0.83 SELL (0.47) ALOX5HDAC1HDAC2HDAC3SELL
SCHEMBL9313474 0.78 SELL (0.58) ALOX5HDAC1HDAC6SELLSELP
SCHEMBL11618503 0.73 KMT2A (0.56) HDAC1HDAC2HDAC3HDAC4HDAC7
SCHEMBL11115291 0.72 ALDH1A1 (0.56) HDAC1HDAC2HDAC3HDAC4HDAC7
SCHEMBL24871622 0.72 ALOX5 (0.57) ALOX5SELLSELPDNM2
SCHEMBL9143670 0.72 NAAA (0.68) ALOX5
SCHEMBL31099240 0.72 SELL (0.55) ALOX5HDAC1SELLSELP
SCHEMBL13952095 0.71 ALOX5 (0.82) ALOX5DNM2
SCHEMBL368400 0.71 HDAC1 (0.53) HDAC1HDAC2HDAC3HDAC4HDAC7
SCHEMBL6385721 0.70 HDAC6 (0.76) HDAC1HDAC2HDAC3HDAC4HDAC7

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250197383-A1 SMALL MOLECULE INHIBITORS OF ENPP1 UNIV CALIFORNIA (US) 2025-06-19 US disclosed
EP-4486738-A1 SMALL MOLECULE INHIBITORS OF ENPP1 THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2025-01-08 EP disclosed
WO-2023168240-A1 SMALL MOLECULE INHIBITORS OF ENPP1 THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-09-07 WO disclosed
WO-2023168240-A1 SMALL MOLECULE INHIBITORS OF ENPP1 THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-09-07 WO 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-20250197383-A1 SMALL MOLECULE INHIBITORS OF ENPP1 ENPP1, ENPP2, ENPP3 ALOX5 1100/4885HDAC1 2743/4885HDAC2 2556/4885

“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.