SCHEMBL6100632

SCHEMBL6100632

Cc1ccc2c(c1)[C@H](CO)CO2

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 2/20 0.43
HTR2C P28335 2/20 0.43
SLC6A2 P23975 1/20 0.43
HTR2B P41595 1/20 0.43
SIGMAR1 Q99720 1/20 0.43
HTR1D P28221 1/20 0.42
FFAR1 O14842 6/20 0.41
PPARG P37231 2/20 0.41
PPARD Q03181 2/20 0.41
HCRTR2 O43614 1/20 0.41
KDM4C Q9H3R0 1/20 0.39
CYP19A1 P11511 2/20 0.37
ADRA2A P08913 1/20 0.37
CA2 P00918 1/20 0.37
TRPM5 Q9NZQ8 1/20 0.35

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
SCHEMBL30295621 1.00 HTR1A (0.43) HTR1AHTR2CSLC6A2HTR2BSIGMAR1
SCHEMBL28705121 0.92 HCRTR2 (0.40) HTR1AHTR2CSLC6A2HTR2BSIGMAR1
SCHEMBL12362004 0.86 FFAR1 (0.47) FFAR1PPARGPPARDCYP19A1CA2
SCHEMBL13981216 0.84 HTR1A (0.51) HTR1AHTR2CSLC6A2HTR2BSIGMAR1
SCHEMBL27347334 0.82 FFAR1 (0.60) FFAR1PPARGPPARD
SCHEMBL27347336 0.82 FFAR1 (0.60) FFAR1PPARGPPARD
SCHEMBL27347333 0.82 FFAR1 (0.60) FFAR1PPARGPPARD
SCHEMBL95790 0.80 HTR2C (0.61) HTR1AHTR2CSLC6A2HTR2BSIGMAR1
SCHEMBL30485736 0.79 MAOB (0.46) HTR1AHTR2CHTR1DFFAR1PPARG
SCHEMBL21056035 0.79 MAOB (0.46) HTR1AHTR2CHTR1DFFAR1PPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7153852-B2 Indole compounds, process for producing the same and drugs containing the same as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2006-12-26 US disclosed
US-20050004096-A1 Indole derivatives, process for producing the same and drugs containing the same as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2005-01-06 US disclosed
EP-1424325-A1 INDOLE DERIVATIVES, PROCESS FOR PRODUCING THE SAME AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2004-06-02 EP 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-20050004096-A1 Indole derivatives, process for producing the same and drugs containing the same as the active ingredient IDO1, IDO2, PTGIR HTR1A 50/4885HTR2C 144/4885SLC6A2 2341/4885

“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.