SCHEMBL5069267

SCHEMBL5069267

NC(=O)ON1CCc2ccccc21

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.50
HPGD P15428 2/20 0.50
NOTUM Q6P988 1/20 0.49
TSHR P16473 3/20 0.47
RAB9A P51151 6/20 0.46
SMN1; SMN2 Q16637 5/20 0.46
NPC1 O15118 5/20 0.45
KMT2A Q03164 3/20 0.45
L3MBTL1 Q9Y468 3/20 0.45
MAPT P10636 3/20 0.45
MEN1 O00255 2/20 0.45
TP53 P04637 1/20 0.44
KDM4E B2RXH2 1/20 0.44
POLB P06746 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
SIGMAR1 Q99720 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
SCHEMBL21798510 0.84 NOTUM (0.50) ALDH1A1HPGDNOTUMTSHRRAB9A
SCHEMBL27761216 0.83 NOTUM (0.57) ALDH1A1HPGDNOTUMTSHRRAB9A
SCHEMBL27822313 0.82 ALDH1A1 (0.47) ALDH1A1HPGDNOTUMTSHRRAB9A
SCHEMBL28048629 0.81 NOTUM (0.47) ALDH1A1HPGDNOTUMTSHRRAB9A
SCHEMBL8918372 0.81 NOTUM (0.55) ALDH1A1HPGDNOTUMTSHRRAB9A
SCHEMBL11848148 0.80 NOTUM (0.46) ALDH1A1HPGDNOTUMTSHRRAB9A
SCHEMBL27652751 0.80 KMT2A (0.53) ALDH1A1HPGDNOTUMTSHRRAB9A
SCHEMBL27594651 0.80 MAPT (0.56) ALDH1A1HPGDNOTUMTSHRRAB9A
SCHEMBL27717490 0.80 NOTUM (0.46) ALDH1A1HPGDNOTUMTSHRRAB9A
SCHEMBL6269619 0.79 NOTUM (0.49) ALDH1A1HPGDNOTUMTSHRRAB9A

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113292557-B Pyridopyrimidinone mesoion derivative containing indole unit and preparation method and application thereof 贵州大学 2022-02-11 CN disclosed
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
EP-1328515-B1 INDOLINE DERIVATIVES AND THEIR USE AS 5-HT2 RECEPTOR LIGANDS HOFFMANN LA ROCHE (CH) 2008-08-06 EP disclosed
CN-100334076-C Indoline derivatives and their use as 5-HT2Use of receptor ligands HOFFMANN LA ROCHE CO LTD (CH) 2007-08-29 CN disclosed
CN-1630636-A Indoline derivatives and their use as 5-HT2 receptor ligands HOFFMANN LA ROCHE (CH) 2005-06-22 CN disclosed
EP-1328515-A1 INDOLINE DERIVATIVES AND THEIR USE AS 5-HT2 RECEPTOR LIGANDS F. Hoffmann-La Roche AG (CH) 2003-07-23 EP disclosed
US-6479534-B1 Indoline derivatives and method of treating obesity VERNALIS RESEARCH LIMITED (GB) 2002-11-12 US disclosed
WO-2002044152-A1 INDOLINE DERIVATIVES AND THEIR USE AS 5-HT2 RECEPTOR LIGANDS F. HOFFMANN-LA ROCHE AG (CH) 2002-06-06 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 ALDH1A1 840/4885HPGD 1286/4885NOTUM 2798/4885

“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.