SCHEMBL7755602

SCHEMBL7755602

COc1ccc2nc3ccccc3nc2c1OC

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NQO2 P16083 12/20 0.67
MAPT P10636 5/20 0.67
RAB9A P51151 4/20 0.67
NPC1 O15118 3/20 0.67
THRB P10828 2/20 0.67
BLM P54132 2/20 0.67
KDM4E B2RXH2 2/20 0.67
GAA P10253 1/20 0.67
MAPK1 P28482 1/20 0.67
ATM Q13315 1/20 0.67
L3MBTL1 Q9Y468 1/20 0.67
MEN1 O00255 5/20 0.53
KMT2A Q03164 5/20 0.53
ALDH1A1 P00352 5/20 0.53
POLB P06746 4/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
CASP6 P55212 1/20 0.53
LMNA P02545 2/20 0.49
G6PD P11413 1/20 0.49
PKM P14618 1/20 0.49

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
Cinnamic Acid SCHEMBL8847518 0.81 TNFRSF1A (0.48) NQO2MAPTRAB9ANPC1THRB
SCHEMBL18387433 0.80 NQO2 (0.65) NQO2MAPTRAB9ANPC1THRB
SCHEMBL2373965 0.80 MAPT (1.00) NQO2MAPTRAB9ANPC1THRB
SCHEMBL28033039 0.79 PDE3B (0.45) NQO2MAPTRAB9ANPC1THRB
SCHEMBL1513023 0.79 NQO2 (1.00) NQO2MAPTRAB9ANPC1THRB
SCHEMBL8740326 0.77 NQO2 (0.61) NQO2MAPTRAB9ANPC1THRB
SCHEMBL2923055 0.77 NQO2 (0.55) NQO2MAPTRAB9ANPC1THRB
Hydrochloric Acid SCHEMBL28752582 0.77 NQO2 (0.96) NQO2MAPTRAB9ANPC1THRB
Hydrochloric Acid SCHEMBL27564424 0.77 NQO2 (0.96) NQO2MAPTRAB9ANPC1THRB
Ammonia Solution, Strong SCHEMBL27633219 0.77 NQO2 (0.96) NQO2MAPTRAB9ANPC1THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114364666-A Substituted N-phenyl-N-semicarbazides pyrimidines and salts thereof and their use as herbicides 拜耳公司 2022-04-15 CN disclosed
CN-1314400-C Solid preparation taken through oral cavity of compound MEthoxyphEnaminE and preparation method RONGLI MEDICINE TECH CO LTD HA (CN) 2007-05-09 CN disclosed
WO-2001068042-A1 METHOD FOR DYEING DRY HAIR NOVOZYMES A/S (DK) 2001-09-20 WO disclosed
EP-1076494-A1 RE-FORMATION OF KERATINOUS FIBRE CROSS LINKS Novozymes A/S (DK) 2001-02-21 EP disclosed
WO-1999058013-A1 RE-FORMATION OF KERATINOUS FIBRE CROSS LINKS NOVO NORDISK A/S (DK) 1999-11-18 WO disclosed
EP-0891182-A1 AN ENZYME FOR DYEING KERATINOUS FIBRES NOVO NORDISK A/S (DK) 1999-01-20 EP disclosed
EP-0863950-A1 AN ENZYME FOR DYING KERATINOUS FIBRES NOVO NORDISK A/S (DK) 1998-09-16 EP disclosed
WO-1997037633-A1 AN ENZYME FOR DYEING KERATINOUS FIBRES NOVO NORDISK A/S (DK) 1997-10-16 WO disclosed
WO-1997019998-A1 AN ENZYME FOR DYING KERATINOUS FIBRES NOVO NORDISK A/S (DK) 1997-06-05 WO disclosed