SCHEMBL3266953

SCHEMBL3266953

COc1cccc(CO)c1COc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.46
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
BCHE P06276 2/20 0.43
ALDH1A1 P00352 1/20 0.43
ABCB1 P08183 5/20 0.43
HTR1A P08908 2/20 0.43
DRD2 P14416 2/20 0.43
MAOB P27338 2/20 0.41
CD274 Q9NZQ7 4/20 0.41
KDM4E B2RXH2 1/20 0.41
IDO1 P14902 1/20 0.41
ABCG2 Q9UNQ0 1/20 0.40
PTGER4 P35408 1/20 0.40

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
SCHEMBL1029593 0.79 PDE4A (0.45) L3MBTL1ALDH1A1CD274KDM4EIDO1
SCHEMBL4779293 0.78 ABCB1 (0.62) L3MBTL1MEN1KMT2ABCHEALDH1A1
SCHEMBL6300999 0.78 HSP90AA1 (0.50) L3MBTL1MEN1KMT2AABCB1HTR1A
SCHEMBL16954472 0.76 ALOX5 (0.45) L3MBTL1ALDH1A1CD274KDM4EIDO1
SCHEMBL23116 0.76 ABCB1 (0.55) L3MBTL1MEN1KMT2ABCHEALDH1A1
SCHEMBL3266741 0.75 ERN1 (0.50) KMT2AALDH1A1MAOB
SCHEMBL8135903 0.75 PDE4A (0.41) L3MBTL1ALDH1A1CD274KDM4EIDO1
SCHEMBL3266332 0.74 PTPRC (0.55) ALDH1A1HTR1AKDM4EPTGER4
SCHEMBL17820 0.73 IDO1 (0.57) ALDH1A1IDO1
SCHEMBL30829273 0.73 IDO1 (0.57) ALDH1A1IDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1335907-B1 PIPERAZINYLPYRAZINE COMPOUNDS AS AGONIST OR ANTAGONIST OF SEROTONIN 5HT-2 RECEPTOR BIOVITRUM AB PUBL (SE) 2010-06-09 EP disclosed
US-7247633-B2 Pyrimidine compounds and their use BIOVITRUM AB (SE) 2007-07-24 US disclosed
US-20040014767-A1 Novel compounds and their use BIOVITRUM AB, A SWEDISH CORPORATION 2004-01-22 US disclosed
EP-1335907-A1 PIPERAZINYLPYRAZINE COMPOUNDS AS AGONIST OR ANTAGONIST OF SEROTONIN 5HT-2 RECEPTOR BIOVITRUM AB (SE) 2003-08-20 EP disclosed
US-6593330-B2 Central nervous system disorders; antiserotonine agents BIOVITRUM (SE) 2003-07-15 US disclosed
US-20020147200-A1 Novel compounds and their use PROXIMAGEN NEUROSCIENCE PLC (GB) 2002-10-10 US disclosed
WO-2002040456-A1 PIPERAZINYLPYRAZINE COMPOUNDS AS AGONIST OR ANTAGONIST OF SEROTONIN 5HT-2 RECEPTOR BIOVITRUM AB (SE) 2002-05-23 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 (2 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-20020147200-A1 Novel compounds and their use BRIX1, UGT1A1, NR5A1 L3MBTL1 644/4885MEN1 633/4885KMT2A 1705/4885
US-20040014767-A1 Novel compounds and their use BRIX1, UGT1A1, NR5A1 L3MBTL1 644/4885MEN1 633/4885KMT2A 1705/4885

“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.