SCHEMBL10348908

SCHEMBL10348908

COc1ccc2c(c1)CCNC2Cc1ccc(O)c(O)c1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.69
KMT2A Q03164 2/20 0.69
ABL1 P00519 1/20 0.69
ALPL P05186 1/20 0.69
GAA P10253 1/20 0.69
RIN1 Q13671 1/20 0.69
DRD2 P14416 1/20 0.69
DRD4 P21917 1/20 0.69
KDM4E B2RXH2 2/20 0.65
MAPT P10636 2/20 0.65
PKM P14618 2/20 0.65
TDP1 Q9NUW8 1/20 0.65
ADRB2 P07550 3/20 0.59
ADRB1 P08588 3/20 0.59
ADRB3 P13945 3/20 0.59
TBXA2R P21731 2/20 0.59
HTR1A P08908 1/20 0.59
ADRA2A P08913 1/20 0.59
DRD1 P21728 1/20 0.59
PTGS1 P23219 1/20 0.59

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
SCHEMBL10349425 0.92 KDM4E (0.73) MEN1KMT2AABL1ALPLGAA
SCHEMBL10799546 0.91 KDM4E (0.69) MEN1KMT2AABL1ALPLGAA
SCHEMBL6989677 0.91 MEN1 (0.60) MEN1KMT2AABL1ALPLGAA
SCHEMBL13430578 0.91 KDM4E (0.69) MEN1KMT2AABL1ALPLGAA
SCHEMBL10223068 0.91 KDM4E (0.69) MEN1KMT2AABL1ALPLGAA
SCHEMBL10348856 0.91 MEN1 (0.69) MEN1KMT2AABL1ALPLGAA
SCHEMBL16627028 0.90 MEN1 (0.59) MEN1KMT2AABL1ALPLGAA
SCHEMBL21328333 0.88 BCHE (0.72) MEN1KMT2ADRD2DRD4KDM4E
SCHEMBL21346200 0.88 KDM4E (0.60) MEN1KMT2AKDM4EMAPTPKM
SCHEMBL21346198 0.88 KDM4E (0.60) MEN1KMT2AKDM4EMAPTPKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0154035-B1 S-TETRAHYDROPROTOBERBERINOXIDASE, PROCESS FOR ITS PREPARATION AND ITS USE Consortium für elektrochemische Industrie GmbH (DE) 1990-07-25 EP disclosed
US-4657861-A S-tetrahydroprotoberberineoxidase, process for producing the same and use thereof CONSORTIUM FUR ELEKTROCHEMISCHE INDUSTRIE GMBH (DE) 1987-04-14 US disclosed
EP-0154035-A2 S-tetrahydroprotoberberinoxidase, process for its preparation and its use Consortium für elektrochemische Industrie GmbH (DE) 1985-09-11 EP disclosed