SCHEMBL6400290

SCHEMBL6400290

O=C(NN1C(=O)CCN(c2ccccc2)C1=O)c1cc2cc(Cl)ccc2[nH]1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 4/20 0.53
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
RXFP1 Q9HBX9 1/20 0.48
NHERF1 O14745 2/20 0.47
IDO1 P14902 1/20 0.47
GUSB P08236 1/20 0.47
HRH3 Q9Y5N1 2/20 0.47
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
PYGL P06737 6/20 0.45
F7 P08709 1/20 0.45
F3 P13726 1/20 0.45
PYGM P11217 4/20 0.45
HRH1 P35367 1/20 0.45
EGFR P00533 1/20 0.45
CYP51A1 Q16850 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
SCHEMBL6400322 0.91 HRH4 (0.53) HRH4MEN1KMT2ARXFP1NHERF1
SCHEMBL6400106 0.85 HRH4 (0.55) HRH4MEN1KMT2ANHERF1IDO1
SCHEMBL6400096 0.83 HRH4 (0.51) HRH4MEN1KMT2ANHERF1IDO1
SCHEMBL6401657 0.80 HRH4 (0.53) HRH4MEN1KMT2ARXFP1NHERF1
SCHEMBL6399693 0.78 HRH4 (0.57) HRH4MEN1KMT2ARXFP1NHERF1
SCHEMBL6407409 0.75 HRH4 (0.54) HRH4MEN1KMT2ARXFP1NHERF1
SCHEMBL6400051 0.74 HRH4 (0.53) HRH4MEN1KMT2ANHERF1GUSB
SCHEMBL31058769 0.69 NHERF1 (0.78) MEN1KMT2ARXFP1NHERF1GUSB
SCHEMBL7974649 0.69 MEN1 (0.47) HRH4MEN1KMT2ARXFP1HRH3
SCHEMBL4933623 0.69 F7 (0.66) HRH4MEN1KMT2ARXFP1NHERF1

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
US-20050054696-A1 Indole compounds and medicinal use thereof JAPAN TOBACCO INC. (JP) 2005-03-10 US disclosed
EP-1452526-A1 INDOLE COMPOUND AND MEDICINAL USE THEREOF JAPAN TOBACCO INC. (JP) 2004-09-01 EP 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-20050054696-A1 Indole compounds and medicinal use thereof IDO1, GPR119, SLC5A1 HRH4 1853/4885MEN1 1510/4885KMT2A 673/4885

“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.