SCHEMBL7915015

SCHEMBL7915015

O=C(c1ccccc1)c1cnn(-c2ccccc2)c1-c1ccccc1

nearest known ligand 0.74

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 7/20 0.66
ALDH1A1 P00352 2/20 0.60
MEN1 O00255 1/20 0.56
KMT2A Q03164 1/20 0.56
PTGS2 P35354 1/20 0.51
MAPT P10636 2/20 0.49
CYP3A4 P08684 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
MAPK1 P28482 1/20 0.49
RIPK2 O43353 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.47
NR4A3 Q92570 1/20 0.47
POLB P06746 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47

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
SCHEMBL21409620 0.87 MAPK14 (0.55) MAPK14ALDH1A1MEN1KMT2APTGS2
SCHEMBL4497271 0.85 ALDH1A1 (0.65) MAPK14ALDH1A1MEN1KMT2AMAPT
SCHEMBL8190034 0.79 MAPK14 (0.48) MAPK14ALDH1A1MAPTNPSR1POLB
SCHEMBL13662120 0.79 MAPK14 (1.00) MAPK14ALDH1A1RIPK2POLB
Hydrochloric Acid SCHEMBL6311724 0.77 SLC9A1 (0.69) MAPK14ALDH1A1MEN1KMT2APTGS2
SCHEMBL15750441 0.76 LMNA (0.58) MAPK14ALDH1A1MEN1KMT2AMAPT
SCHEMBL4828987 0.76 ALDH1A1 (1.00) ALDH1A1MEN1KMT2ACYP3A4CYP2C9
SCHEMBL15750496 0.74 RIPK2 (0.58) MAPK14ALDH1A1MEN1KMT2APTGS2
Hydrochloric Acid SCHEMBL6311714 0.74 MEN1 (0.58) MAPK14ALDH1A1MEN1KMT2AMAPK1
SCHEMBL21409634 0.74 RAB9A (0.46) MAPK14ALDH1A1MEN1KMT2APTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0872903-B1 Method for making hydrogen storage alloy powder and electrode comprising the alloy powder SHINETSU CHEMICAL CO (JP) 2001-10-04 EP disclosed
US-6277519-B1 QUENCHING AN ALLOY MELT; COMMINUTION SHIN-ETSU CHEMICAL CO., LTD. (JP) 2001-08-21 US disclosed
US-6096144-A TREATING WITH ACIDIC OR ALKALINE SOLUTION OF CONJUGATED UNSATURATED COMPOUND WITH AT LEAST 5 BONDS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2000-08-01 US disclosed
US-5858571-A TREATING A PULVERIZED HYDROGEN ABSORBING ALLOY WITH A SOLUTION COMPRISING A CONJUGATED UNSATURATED COMPOUND SHIN-ETSU CHEMICAL CO., LTD. (JP) 1999-01-12 US disclosed
EP-0872903-A1 Method for making hydrogen storage alloy powder and electrode comprising the alloy powder Shin-Etsu Chemical Co., Ltd. (JP) 1998-10-21 EP disclosed
CN-1006386-B PROCESS FOR PRODUCTION OF VINYL CHLORIDE POLYMER SHINETSU CHEM IND CO (JP) 1990-01-10 CN disclosed
EP-0172427-B1 PROCESS FOR PRODUCTION OF VINYL CHLORIDE POLYMER Shin-Etsu Chemical Co., Ltd. (JP) 1989-07-05 EP disclosed
US-4758639-A Process for production of vinyl polymer SHIN-ETSU CHEMICAL CO., LTD. (JP) 1988-07-19 US disclosed
US-4757124-A Suspension or emulsion polymerizing vinyl chloride monomer or mixture of vinyl chloride with vinyl monomer copolymerizable therewith in reactor with walls coated with antiscaling compound containing dye or pigments SHIN-ETSU CHEMICAL CO., LTD. (JP) 1988-07-12 US disclosed
CN-85107531-A Process for producing vinyl chloride polymer 1987-01-21 CN disclosed
EP-0172427-A2 Process for production of vinyl chloride polymer Shin-Etsu Chemical Co., Ltd. (JP) 1986-02-26 EP disclosed