SCHEMBL2994797

SCHEMBL2994797

Cc1ccc2c(c1)c(C(=O)C(=O)Nc1ccc(Cl)cc1)c(Cl)n2Cc1ccc(Cl)cc1

nearest known ligand 0.63

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.63
MEN1 O00255 1/20 0.50
HTT P42858 1/20 0.50
KMT2A Q03164 1/20 0.50
MAPT P10636 3/20 0.48
TP53 P04637 2/20 0.47
CNR1 P21554 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
PLA2G4A P47712 1/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43

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
SCHEMBL4383595 0.98 FAAH (0.61) FAAHMEN1HTTKMT2AMAPT
SCHEMBL3008672 0.95 FAAH (0.60) FAAHMEN1HTTKMT2AMAPT
SCHEMBL4088958 0.93 FAAH (0.64) FAAHMEN1HTTKMT2AMAPT
SCHEMBL2171179 0.93 FAAH (0.66) FAAHMEN1HTTKMT2AMAPT
SCHEMBL4083947 0.91 FAAH (0.52) FAAHMEN1KMT2AMAPTTP53
SCHEMBL2170308 0.91 FAAH (0.61) FAAHMEN1HTTKMT2AMAPT
SCHEMBL4097912 0.89 FAAH (0.51) FAAHMEN1HTTKMT2AMAPT
SCHEMBL2168887 0.88 FAAH (0.58) FAAHMEN1HTTKMT2AMAPT
SCHEMBL3001446 0.88 FAAH (0.70) FAAHMEN1HTTKMT2AMAPT
SCHEMBL2167911 0.88 FAAH (0.70) FAAHMEN1HTTKMT2AMAPT

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 5 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
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-20100197708-A1 INDOLE COMPOUNDS WELLS FARGO BANK, NATIONAL ASSOCIATION 2010-08-05 US 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 (2 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 FAAH 109/4885MEN1 3970/4885HTT 632/4885
US-20090118503-A1 FAAH INHIBITORS FAAH, FAAH2, CNR2 FAAH 1/4885MEN1 4573/4885HTT 1985/4885

“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.