SCHEMBL15322764

SCHEMBL15322764

CCN(C)C(=O)Oc1ccc2c(C=Cc3nnn[nH]3)c[nH]c2c1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
BCHE P06276 11/20 0.40
ACHE P22303 8/20 0.40
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
MAPT P10636 1/20 0.37
MAOB P27338 1/20 0.36
MAOA P21397 2/20 0.36
MEN1 O00255 1/20 0.36
NPC1 O15118 1/20 0.36
APOBEC3A P31941 1/20 0.36
RAB9A P51151 1/20 0.36
KMT2A Q03164 1/20 0.36
APOBEC3G Q9HC16 1/20 0.36
FAAH O00519 1/20 0.35

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
SCHEMBL15322761 1.00 BCHE (0.40) BCHEACHEKDM4EALDH1A1MAPT
SCHEMBL15325600 0.80 ALDH1A1 (0.58) BCHEACHEKDM4EALDH1A1MAPT
SCHEMBL15323027 0.79 BCHE (0.43) BCHEACHEKDM4EALDH1A1MAPT
SCHEMBL15323026 0.79 BCHE (0.43) BCHEACHEKDM4EALDH1A1MAPT
SCHEMBL16589523 0.79 BCHE (0.47) BCHEACHEKDM4EALDH1A1MAPT
SCHEMBL15323720 0.79 BCHE (0.44) BCHEACHEMAOBMAOA
SCHEMBL15323717 0.79 BCHE (0.44) BCHEACHEMAOBMAOA
SCHEMBL15324505 0.78 MAPT (0.48) BCHEACHEKDM4EALDH1A1MAPT
SCHEMBL15324508 0.78 MAPT (0.48) BCHEACHEKDM4EALDH1A1MAPT
SCHEMBL15322884 0.78 BCHE (0.50) BCHEACHEMEN1KMT2A

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-9499484-B2 Indole, indoline derivatives, compositions comprising them and uses thereof YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM LTD (IL) 2016-11-22 US disclosed
US-20150087617-A1 INDOLE, INDOLINE DERIVATIVES, COMPOSITIONS COMPRISING THEM AND USES THEREOF YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM LTD (IL) 2015-03-26 US disclosed
EP-2847165-A2 INDOLE, INDOLINE DERIVATIVES, COMPOSITIONS COMPRISING THEM AND USES THEREOF Yissum Research Development Company of the Hebrew University of Jerusalem Ltd. (IL) 2015-03-18 EP disclosed
WO-2013150529-A2 INDOLE, INDOLINE DERIVATIVES, COMPOSITIONS COMPRISING THEM AND USES THEREOF YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM LTD (IL) 2013-10-10 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-20150087617-A1 INDOLE, INDOLINE DERIVATIVES, COMPOSITIONS COMPRISING THEM AND USES THEREOF IDO1, INMT, IDO2 BCHE 466/4885ACHE 60/4885KDM4E 973/4885

“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.