SCHEMBL6904482

SCHEMBL6904482

Cc1cc(C)c2c(c1)C(=O)c1c(C)cc(C)cc1C2=O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 4/20 0.45
ALDH1A1 P00352 3/20 0.45
MAPT P10636 3/20 0.45
PIM1 P11309 3/20 0.45
ALOX15 P16050 2/20 0.45
MEN1 O00255 2/20 0.45
CYP3A4 P08684 2/20 0.45
TSHR P16473 2/20 0.45
MAPK1 P28482 2/20 0.45
KMT2A Q03164 2/20 0.45
TDP1 Q9NUW8 2/20 0.45
MAOA P21397 2/20 0.45
MAOB P27338 2/20 0.45
NPC1 O15118 1/20 0.45
PTP4A3 O75365 1/20 0.45
GMNN O75496 1/20 0.45
LMNA P02545 1/20 0.45
ESR1 P03372 1/20 0.45
TP53 P04637 1/20 0.45
CYP1A1 P04798 1/20 0.45

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
SCHEMBL6900343 0.92 ELANE (0.53) ELANEALDH1A1MAPTPIM1ALOX15
SCHEMBL27563138 0.91 ELANE (0.44) ELANEALDH1A1MAPTPIM1ALOX15
SCHEMBL6036547 0.90 ELANE (0.45) ELANEALDH1A1MAPTPIM1ALOX15
SCHEMBL12111227 0.90 ELANE (0.50) ELANEALDH1A1MAPTPIM1ALOX15
SCHEMBL985103 0.87 TTR (0.62) ELANEALDH1A1MAPTMEN1CYP3A4
SCHEMBL6905738 0.85 ELANE (0.62) ELANEALDH1A1MAPTPIM1ALOX15
SCHEMBL31379951 0.85 ELANE (0.62) ELANEALDH1A1MAPTPIM1ALOX15
SCHEMBL8668950 0.83 ELANE (0.53) ELANEALDH1A1MAPTPIM1MEN1
SCHEMBL27393811 0.81 ELANE (0.44) ELANEALDH1A1MAPTPIM1ALOX15
SCHEMBL12460172 0.78 ELANE (0.59) ELANEALDH1A1MAPTMEN1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0201368-B1 MARKING AND DENATURING COMPOSITION, PARTICULARLY SUITABLE FOR MARKING AND DENATURING DIESEL OIL AND SIMILAR OIL PRODUCTS BASF Italia SpA (IT) 1989-07-19 EP claimed
CN-1239447-C Organic electroluminescent material UNIV TSINGHUA (CN) 2006-02-01 CN disclosed
US-6815481-B2 FUSED DIBENZO THERMAL STABILIZERS SUCH AS ANTHRACENE, XANTHENE AND ANTHRONE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2004-11-09 US disclosed
CN-1362464-A Organic electroluminescent material UNIV QINGHUA (CN) 2002-08-07 CN disclosed
US-20020032256-A1 Polybutadiene composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-03-14 US disclosed
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-0201368-B1 MARKING AND DENATURING COMPOSITION, PARTICULARLY SUITABLE FOR MARKING AND DENATURING DIESEL OIL AND SIMILAR OIL PRODUCTS BASF Italia SpA (IT) 1989-07-19 EP 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
US-4355012-A Mixed anthraquinonedisulfonic acids AMERICAN COLOR & CHEMICAL CORPORATION (US) 1982-10-19 US disclosed