SCHEMBL4089949

SCHEMBL4089949

Cc1ccc2c(c1)c(C(=O)C(=O)Nc1ccccn1)c(C(F)(F)F)n2Cc1ccc(Cl)cc1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.54
KMT2A Q03164 2/20 0.42
HTT P42858 2/20 0.41
MEN1 O00255 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.39
KDM4E B2RXH2 1/20 0.39
NPC1 O15118 1/20 0.39
ALDH1A1 P00352 1/20 0.39
RAB9A P51151 1/20 0.39
PTGER1 P34995 1/20 0.39
P2RX3 P56373 1/20 0.39
MAPT P10636 1/20 0.38
THRB P10828 1/20 0.38
HPGD P15428 1/20 0.38

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
SCHEMBL4090183 0.93 KMT2A (0.45) FAAHKMT2AMEN1NPC1RAB9A
SCHEMBL4100635 0.90 FAAH (0.43) FAAHKMT2AMEN1SMN1; SMN2NPC1
SCHEMBL3007458 0.90 FAAH (0.56) FAAHKMT2AHTTMEN1SMN1; SMN2
SCHEMBL3011555 0.90 FAAH (0.44) FAAHKMT2AHTTMEN1SMN1; SMN2
SCHEMBL4087908 0.89 KMT2A (0.47) FAAHKMT2AMEN1NPC1RAB9A
SCHEMBL4095302 0.89 FAAH (0.48) FAAHKMT2AMEN1NPC1ALDH1A1
SCHEMBL4101976 0.89 FAAH (0.53) FAAHKMT2AHTTMEN1KDM4E
SCHEMBL4562856 0.89 FAAH (0.53) FAAHKMT2AHTTMEN1KDM4E
SCHEMBL4088689 0.88 FAAH (0.44) FAAHKMT2A
SCHEMBL2999824 0.88 FAAH (0.58) FAAHKMT2AHTTMEN1SMN1; SMN2

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 2 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
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 1/4885KMT2A 2103/4885HTT 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.