SCHEMBL8156018

SCHEMBL8156018

CC(C)c1ccc2c(c1)Sc1ccccc1N2

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOX1 Q9Y5S8 10/20 0.62
MAPT P10636 7/20 0.59
GAA P10253 5/20 0.59
SNCA P37840 4/20 0.59
MEN1 O00255 3/20 0.59
KMT2A Q03164 3/20 0.59
ALOX15 P16050 3/20 0.59
TDP1 Q9NUW8 2/20 0.59
BCHE P06276 2/20 0.59
ACHE P22303 2/20 0.59
CYP1A2 P05177 2/20 0.59
POLB P06746 1/20 0.59
CYP3A4 P08684 1/20 0.59
ADORA3 P0DMS8 1/20 0.59
ALOX12 P18054 1/20 0.59
MAOA P21397 1/20 0.59
CNR1 P21554 1/20 0.59
PTGS1 P23219 1/20 0.59
SLC6A2 P23975 1/20 0.59
HTR2C P28335 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
SCHEMBL30467250 0.91 SNCA (0.50) NOX1MAPTGAASNCAMEN1
SCHEMBL28470729 0.91 SNCA (0.50) NOX1MAPTGAASNCAMEN1
SCHEMBL11580945 0.90 NOX1 (0.77) NOX1MAPTGAASNCAMEN1
SCHEMBL2706291 0.88 NOX1 (0.59) NOX1MAPTGAASNCAMEN1
SCHEMBL27477204 0.87 NOX1 (0.59) NOX1MAPTGAASNCAMEN1
SCHEMBL885358 0.85 NOX1 (0.57) NOX1MAPTGAASNCAMEN1
SCHEMBL2756739 0.82 NOX1 (0.50) NOX1MAPTGAASNCAMEN1
SCHEMBL22960441 0.82 NOX1 (0.65) NOX1MAPTGAASNCAMEN1
SCHEMBL22960495 0.81 NOX1 (0.68) NOX1MAPTGAASNCAMEN1
SCHEMBL885286 0.79 NOX1 (0.50) NOX1MAPTGAASNCAMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-57115435-A None JP disclosed
EP-2998303-B1 PHENOTHIAZINE DERIVATIVES AND METHODS FOR TREATING TUMORS B & G PARTNERS LLC (US) 2018-06-13 EP disclosed
EP-2998303-A1 PHENOTHIAZINE DERIVATIVES AND METHODS FOR TREATING TUMORS B & G Partners, LLC (US) 2016-03-23 EP disclosed
US-9198916-B1 Compounds and methods for treating tumors B&G PARTNERS, LLC (US) 2015-12-01 US disclosed
JP-2000191643-A STABILIZATION OF ALDEHYDE PYRIDINES KOEI CHEM CO LTD 2000-07-11 JP disclosed
JP-S57115435-A DEGRADATION PREVENTIVE AGENT SUMITOMO CHEM CO LTD 1982-07-17 JP disclosed