SCHEMBL2007408

SCHEMBL2007408

Cc1c(CC(=O)O)c2cccc(C(=O)O)c2n1Cc1cccc(O)c1

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FABP4 P15090 4/20 0.58
PTGDR2 Q9Y5Y4 7/20 0.50
THRA P10827 1/20 0.47
THRB P10828 1/20 0.47
PLA2G2A P14555 5/20 0.47
FOLH1 Q04609 1/20 0.47
PLA2G1B P04054 1/20 0.46
FABP3 P05413 2/20 0.44

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
SCHEMBL2003897 0.90 PTGDR2 (0.53) PTGDR2THRATHRBPLA2G2AFOLH1
SCHEMBL2011533 0.88 FABP4 (0.60) FABP4PTGDR2THRATHRBPLA2G2A
SCHEMBL2001732 0.88 PLA2G2A (0.49) FABP4PTGDR2PLA2G2AFOLH1FABP3
SCHEMBL1999432 0.86 FABP4 (0.46) FABP4PTGDR2THRATHRBFOLH1
SCHEMBL1998402 0.82 PLA2G2A (0.53) PTGDR2THRATHRBPLA2G2AFOLH1
SCHEMBL2007900 0.81 PLA2G2A (0.63) PTGDR2THRATHRBPLA2G2AFOLH1
SCHEMBL2006571 0.81 PLA2G2A (0.59) PTGDR2THRATHRBPLA2G2AFOLH1
SCHEMBL2002843 0.81 FABP4 (0.53) FABP4PTGDR2THRATHRBPLA2G2A
SCHEMBL2004123 0.80 PLA2G2A (0.71) PTGDR2THRATHRBPLA2G2APLA2G1B
SCHEMBL2003130 0.80 PLA2G2A (0.71) PTGDR2THRATHRBPLA2G2APLA2G1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8884020-B2 Indole compounds IRONWOOD PHARMACEUTICALS, INC. (US) 2014-11-11 US disclosed
US-8884020-B2 Indole compounds IRONWOOD PHARMACEUTICALS, INC. (US) 2014-11-11 US disclosed
US-8884020-B2 Indole compounds IRONWOOD PHARMACEUTICALS, INC. (US) 2014-11-11 US disclosed
EP-2610244-A1 Indole compounds Ironwood Pharmaceuticals, Inc. (US) 2013-07-03 EP disclosed
EP-2610244-A1 Indole compounds Ironwood Pharmaceuticals, Inc. (US) 2013-07-03 EP disclosed
CN-102850324-A Indole compounds MICROBIA INC 2013-01-02 CN disclosed
US-7960544-B2 Useful indole compounds IRONWOOD PHARMACEUTICALS, INC. (US) 2011-06-14 US disclosed
US-7960544-B2 Useful indole compounds IRONWOOD PHARMACEUTICALS, INC. (US) 2011-06-14 US disclosed
US-7960544-B2 Useful indole compounds IRONWOOD PHARMACEUTICALS, INC. (US) 2011-06-14 US disclosed
US-20100197708-A1 INDOLE COMPOUNDS WELLS FARGO BANK, NATIONAL ASSOCIATION 2010-08-05 US disclosed
US-20100197708-A1 INDOLE COMPOUNDS WELLS FARGO BANK, NATIONAL ASSOCIATION 2010-08-05 US disclosed
US-20100197708-A1 INDOLE COMPOUNDS WELLS FARGO BANK, NATIONAL ASSOCIATION 2010-08-05 US disclosed
US-20090264653-A1 USEFUL INDOLE COMPOUNDS IRONWOOD PHARMACEUTICALS, INC. 2009-10-22 US disclosed
US-20090264653-A1 USEFUL INDOLE COMPOUNDS IRONWOOD PHARMACEUTICALS, INC. 2009-10-22 US disclosed
US-20090264653-A1 USEFUL INDOLE COMPOUNDS IRONWOOD PHARMACEUTICALS, INC. 2009-10-22 US disclosed
CN-101563337-A Indole compounds MICROBIA INC (US) 2009-10-21 CN disclosed
EP-2049520-A2 INDOLE COMPOUNDS Ironwood Pharmaceuticals, Inc. (US) 2009-04-22 EP disclosed
WO-2008019357-A2 INDOLE COMPOUNDS IRONWOOD PHARMACEUTICALS, INC. (US) 2008-02-14 WO disclosed
US-20070203209-A1 Useful indole compounds IRONWOOD PHARMACEUTICALS, INC. 2007-08-30 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 (3 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-20100197708-A1 INDOLE COMPOUNDS IDO1, IDO2, TPH2 FABP4 559/4885PTGDR2 68/4885THRA 1983/4885
US-20070203209-A1 Useful indole compounds TPH2, HRH2, HRH1 FABP4 3309/4885PTGDR2 28/4885THRA 1963/4885
US-20090264653-A1 USEFUL INDOLE COMPOUNDS FAAH, FAAH2, AANAT FABP4 783/4885PTGDR2 157/4885THRA 2755/4885

“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.