SCHEMBL4097877

SCHEMBL4097877

COc1ccc(NC(=O)C(=O)c2c(Cl)n(Cc3ccc(Cl)cc3Cl)c3ccc(C)cc23)cc1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.51
KCNH2 Q12809 2/20 0.46
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
USP2 O75604 1/20 0.43
PLA2G2A P14555 2/20 0.42
MAPT P10636 4/20 0.40
RXFP1 Q9HBX9 2/20 0.40
THRB P10828 1/20 0.39

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
SCHEMBL4384519 0.96 FAAH (0.48) FAAHKCNH2MEN1KMT2ANPC1
SCHEMBL4088721 0.94 KCNH2 (0.48) FAAHKCNH2MEN1KMT2ANPC1
SCHEMBL4089993 0.94 KMT2A (0.48) FAAHKCNH2MEN1KMT2ANPC1
SCHEMBL4097912 0.93 FAAH (0.51) FAAHMEN1KMT2ASMN1; SMN2USP2
SCHEMBL4098796 0.92 KMT2A (0.46) FAAHKCNH2MEN1KMT2ANPC1
SCHEMBL4384405 0.92 FAAH (0.51) FAAHMEN1KMT2ASMN1; SMN2USP2
SCHEMBL4096113 0.91 KCNH2 (0.48) FAAHKCNH2MEN1KMT2ANPC1
SCHEMBL3007578 0.91 FAAH (0.51) FAAHMEN1KMT2ANPC1RAB9A
SCHEMBL4089939 0.90 MEN1 (0.45) FAAHKCNH2MEN1KMT2ANPC1
SCHEMBL4100737 0.89 MAPT (0.49) KCNH2SMN1; SMN2MAPTRXFP1

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
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-20090118503-A1 FAAH INHIBITORS IRONWOOD PHARMACEUTICALS, INC. 2009-05-07 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-20090118503-A1 FAAH INHIBITORS FAAH, FAAH2, CNR2 FAAH 1/4885KCNH2 1943/4885MEN1 4573/4885

“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.