SCHEMBL26064394

SCHEMBL26064394

Cc1cc(CNC(=O)OC2CC(C)CCC2C(C)C)ccc1O

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 1/20 0.53
CYP19A1 P11511 2/20 0.48
SERPINE1 P05121 5/20 0.47
EPHX1 P07099 2/20 0.47
P2RX4 Q99571 1/20 0.45
ALDH1A1 P00352 4/20 0.44
HPGD P15428 2/20 0.44
MAPT P10636 2/20 0.44
KDM4E B2RXH2 1/20 0.44
GAA P10253 1/20 0.44
MAPK1 P28482 1/20 0.44
TSHR P16473 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 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
SCHEMBL29246511 0.92 TRPV1 (0.55) TRPV1CYP19A1SERPINE1EPHX1P2RX4
SCHEMBL22697670 0.88 TRPV1 (0.69) TRPV1CYP19A1SERPINE1EPHX1P2RX4
SCHEMBL38354 0.84 TRPV1 (0.47) TRPV1CYP19A1SERPINE1EPHX1P2RX4
SCHEMBL38821 0.84 TRPV1 (0.47) TRPV1CYP19A1SERPINE1EPHX1P2RX4
SCHEMBL12166714 0.82 ALDH1A1 (0.55) CYP19A1SERPINE1EPHX1P2RX4ALDH1A1
SCHEMBL12166539 0.82 ALDH1A1 (0.55) CYP19A1SERPINE1EPHX1P2RX4ALDH1A1
SCHEMBL12166956 0.82 ALDH1A1 (0.55) CYP19A1SERPINE1EPHX1P2RX4ALDH1A1
SCHEMBL2574092 0.82 ALDH1A1 (0.55) CYP19A1SERPINE1EPHX1P2RX4ALDH1A1
SCHEMBL13246428 0.82 SMN1; SMN2 (0.57) CYP19A1SERPINE1EPHX1ALDH1A1HPGD
SCHEMBL2573844 0.82 SMN1; SMN2 (0.57) CYP19A1SERPINE1EPHX1ALDH1A1HPGD

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-11731991-B2 Augmenting moieties for anti-inflammatory compounds LEHIGH UNIVERSITY (US) 2023-08-22 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-11731991-B2 Augmenting moieties for anti-inflammatory compounds LTC4S, VCAM1, PTGES TRPV1 17/4885CYP19A1 1032/4885SERPINE1 1910/4885

“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.