SCHEMBL4094014

SCHEMBL4094014

Cc1c(C(=O)C(=O)NC2CCCCC2)c2ccccc2n1Cc1ccc(Cl)cc1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.52
RAB9A P51151 1/20 0.49
MAPT P10636 1/20 0.48
POLB P06746 3/20 0.48
HTT P42858 1/20 0.47
EPHX1 P07099 1/20 0.46
CNR2 P34972 2/20 0.46
KMT2A Q03164 1/20 0.45
PPARG P37231 1/20 0.45
TBXA2R P21731 1/20 0.44
PTGDR Q13258 1/20 0.44
FAAH O00519 1/20 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
SCHEMBL3009812 0.95 POLB (0.50) TP53RAB9AMAPTPOLBHTT
SCHEMBL3006654 0.91 POLB (0.53) TP53RAB9APOLBHTTCNR2
SCHEMBL4083893 0.90 CNR2 (0.50) TP53RAB9AMAPTPOLBEPHX1
SCHEMBL3006153 0.90 TP53 (0.54) TP53RAB9APOLBEPHX1CNR2
SCHEMBL2996526 0.89 KMT2A (0.51) RAB9APOLBCNR2KMT2AFAAH
SCHEMBL3000341 0.89 TP53 (0.52) TP53RAB9APOLBEPHX1CNR2
SCHEMBL2992971 0.88 FAAH (0.57) TP53RAB9AMAPTPOLBHTT
SCHEMBL4089843 0.88 MAPT (0.47) TP53RAB9AMAPTPOLBHTT
SCHEMBL3004122 0.86 TP53 (0.50) TP53RAB9APOLBEPHX1KMT2A
SCHEMBL2998814 0.85 LMNA (0.51) TP53RAB9AMAPTPOLBCNR2

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-20090118503-A1 FAAH INHIBITORS IRONWOOD PHARMACEUTICALS, INC. 2009-05-07 US claimed
CN-102850324-A Indole compounds MICROBIA INC 2013-01-02 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

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-20090118503-A1 FAAH INHIBITORS FAAH, FAAH2, CNR2 TP53 4734/4885RAB9A 2477/4885MAPT 2737/4885

“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.