SCHEMBL7877438

SCHEMBL7877438

[c]1ccc(-c2ccccc2)cc1Cc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CALM1 P0DP23 1/20 0.41
AGXT P21549 1/20 0.39
ACMSD Q8TDX5 1/20 0.38
ALDH1A1 P00352 2/20 0.36
RAB9A P51151 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
PTPN1 P18031 2/20 0.36
HRH3 Q9Y5N1 1/20 0.36
PTPN5 P54829 1/20 0.36
BCL2 P10415 1/20 0.35
BCL2L1 Q07817 1/20 0.35
IDH1 O75874 1/20 0.33
TAAR1 Q96RJ0 1/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33
CA14 Q9ULX7 1/20 0.33

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
SCHEMBL16601111 0.81 CALM1 (0.41) CALM1AGXTALDH1A1RAB9ASMN1; SMN2
SCHEMBL2093279 0.80 CALM1 (0.50) CALM1BCL2BCL2L1IDH1
SCHEMBL1370479 0.78 ALDH1A1 (0.36) AGXTACMSDALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL9673115 0.78 ALDH1A1 (0.38) AGXTACMSDALDH1A1PTPN1MAOA
SCHEMBL28489388 0.78 NOTUM (0.38) ACMSDALDH1A1MAOAHPGDTSHR
SCHEMBL27772757 0.78 TAAR1 (0.43) AGXTALDH1A1TAAR1MAOAHPGD
SCHEMBL7014345 0.77 CALM1 (0.41) CALM1ALDH1A1RAB9ABCL2BCL2L1
SCHEMBL6981018 0.77 MAOB (0.42) CALM1ALDH1A1TDP1BCL2BCL2L1
SCHEMBL8602727 0.77 ALOX5 (0.47) CALM1SMN1; SMN2BCL2BCL2L1IDH1
SCHEMBL4757691 0.77 CALM1 (0.41) CALM1AGXTL3MBTL1BCL2BCL2L1

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
US-6168895-B1 AN ELECTROGRAPHIC TONER CONTAINS AN AZO DYE AND A CHARGE CONTROL AGENT CLARIANT GMBH (DE) 2001-01-02 US disclosed
US-6159649-A Electrophotographic, resin-containing, electret, or inkjet compositions containing magenta azo pigment and use thereof CLARIANT GMBH (DE) 2000-12-12 US disclosed
US-6028178-A COUPLING OF 1,2-BIS(2-AMINOPHENOXY)ETHANE BIS-DIAZONIUM SALT WITH 5-ACETOACETYL-AMINOBENZIMIDAZOL-2-ONE IN PRESENCE OF A SURFACTANT, AGGLOMERATION TO FORM YELLOW AZO PIGMENT POWDERS CLARIANT GMBH (DE) 2000-02-22 US disclosed
US-5352281-A Containing nonionic surfactant with specified cloud point HOECHST AKTIENGESELLSCHAFT (DE) 1994-10-04 US disclosed
US-4828622-A Process for preparing highly concentrated aqueous press cakes of solids HOECHST AKTIENGESELLSCHAFT (DE) 1989-05-09 US disclosed
US-4785082-A Process for preparing a highly concentrated aqueous press cakes of an azo disperse dye from dilute aqueous suspension thereof wherein surfactant is added before the dye is isolated HOECHST AKTIENGESELLSCHAFT (DE) 1988-11-15 US disclosed