SCHEMBL8480214

SCHEMBL8480214

COC(=O)c1ccc2c(-c3ccc(OC)cc3)cn(C(=O)c3ccccc3)c2c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 8/20 0.57
KDM4E B2RXH2 3/20 0.49
ALDH1A1 P00352 2/20 0.49
THRB P10828 1/20 0.49
MAPT P10636 2/20 0.46
HTR6 P50406 1/20 0.45
MEN1 O00255 1/20 0.44
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
GABRA1 P14867 1/20 0.43
GABRG2 P18507 1/20 0.43
GABRB3 P28472 1/20 0.43
GABRA5 P31644 1/20 0.43
GABRA3 P34903 1/20 0.43
GABRA2 P47869 1/20 0.43
POLB P06746 1/20 0.43
EGFR P00533 1/20 0.43
CREBBP Q92793 1/20 0.42
BRD9 Q9H8M2 1/20 0.42
CYP1A2 P05177 1/20 0.42

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
SCHEMBL173901 0.82 SCN9A (0.49) KMT2AKDM4EALDH1A1THRBMAPT
SCHEMBL8360539 0.78 SCN9A (0.46) KMT2AKDM4EALDH1A1MAPTMEN1
SCHEMBL146186 0.76 SCN9A (0.44) KMT2AKDM4EALDH1A1MAPTMEN1
SCHEMBL146859 0.76 SCN9A (0.66) ALDH1A1EGFRCREBBPL3MBTL1
SCHEMBL8482779 0.74 HTR6 (0.54) KMT2AKDM4EALDH1A1THRBHTR6
SCHEMBL28493427 0.73 ALDH1A1 (0.58) KMT2AKDM4EALDH1A1THRBHTR6
SCHEMBL4326615 0.72 SCN9A (0.49) KMT2AKDM4EALDH1A1MAPTMEN1
Methyl 4-Methoxybenzoate SCHEMBL28249391 0.72 CA1 (0.84) KMT2AKDM4EALDH1A1MAPTMEN1
SCHEMBL6701016 0.71 CA1 (0.65) KMT2AKDM4EALDH1A1MAPTMEN1
SCHEMBL8482994 0.71 DYRK1A (0.58) KMT2AKDM4EALDH1A1THRBHTR6

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-5936098-A Process for producing indoline compounds and intermediates for the production of the same TOKYO TANABE COMPANY LIMITED (JP) 1999-08-10 US disclosed
EP-0810214-A1 PROCESS FOR PRODUCING INDOLINE COMPOUNDS AND INTERMEDIATES FOR THE PRODUCTION OF THE SAME TOKYO TANABE COMPANY LIMITED (JP) 1997-12-03 EP disclosed