SCHEMBL3405751

SCHEMBL3405751

C=C(CCC)c1ncc[nH]1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
ALDH1A1 P00352 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
KMT2A Q03164 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP19A1 P11511 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
TXN P10599 1/20 0.32
TXNRD1 Q16881 1/20 0.32
KDM5B Q9UGL1 1/20 0.31
HTR1A P08908 1/20 0.31
TAAR1 Q96RJ0 1/20 0.31
TBXAS1 P24557 1/20 0.31
F2RL1 P55085 3/20 0.31
TLK2 Q86UE8 1/20 0.30

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
SCHEMBL3404042 0.89 CYP1A2 (0.38) NPC1RAB9AALDH1A1SMN1; SMN2KMT2A
SCHEMBL23891726 0.86 KDM4E (0.38) NPC1RAB9AALDH1A1SMN1; SMN2CYP1A2
SCHEMBL3403819 0.84
SCHEMBL9752130 0.82 NPC1 (0.36) NPC1RAB9AALDH1A1SMN1; SMN2KMT2A
SCHEMBL11136272 0.81 KMT2A (0.37) NPC1RAB9AALDH1A1SMN1; SMN2KMT2A
SCHEMBL6158205 0.78
SCHEMBL7574578 0.77 NPC1 (0.46) NPC1RAB9AALDH1A1SMN1; SMN2KMT2A
SCHEMBL11135227 0.76
SCHEMBL8604169 0.74 CYP1A2 (0.39) NPC1RAB9AKMT2ACYP1A2CYP3A4
SCHEMBL15151787 0.74 NPC1 (0.34) NPC1RAB9AALDH1A1SMN1; SMN2F2RL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2260081-A1 SILICA ENCAPSULATED ORGANIC NANOPIGMENTS AND METHOD OF MAKING SAME Xerox Corporation (US) 2010-12-15 EP disclosed
EP-2252664-A1 ENCAPSULATED NANOSCALE PARTICLES OF ORGANIC PIGMENTS Xerox Corporation (US) 2010-11-24 EP disclosed
WO-2009148687-A1 SILICA ENCAPSULATED ORGANIC NANOPIGMENTS AND METHOD OF MAKING SAME XEROX CORPORATION (US) 2009-12-10 WO disclosed
WO-2009126388-A1 ENCAPSULATED NANOSCALE PARTICLES OF ORGANIC PIGMENTS XEROX CORPORATION (US) 2009-10-15 WO disclosed
EP-0939641-A1 TOPICAL PRODUCTS AS PROPHYLACTIC OR CURATIVE AGENTS FOR BACTERIAL SKIN INFECTIONS BASF AKTIENGESELLSCHAFT (DE) 1999-09-08 EP disclosed
EP-0866811-A1 METHOD FOR THE MANUFACTURE OF LOW VISCOSITY AQUEOUS POLYMER DISPERSIONS WITH A POLYMER CONTENT OF AT LEAST 50 VOLUME % BASF AKTIENGESELLSCHAFT (DE) 1998-09-30 EP disclosed
WO-1998016560-A1 METHOD FOR THE MANUFACTURE OF LOW VISCOSITY AQUEOUS POLYMER DISPERSIONS WITH A POLYMER CONTENT OF AT LEAST 50 VOLUME % BASF AKTIENGESELLSCHAFT (DE) 1998-04-23 WO disclosed
WO-1998014199-A1 TOPICAL PRODUCTS AS PROPHYLACTIC OR CURATIVE AGENTS FOR BACTERIAL SKIN INFECTIONS BASF AKTIENGESELLSCHAFT (DE) 1998-04-09 WO disclosed
EP-0828762-A1 WATER-SOLUBLE COPOLYMERS CONTAINING POLYMERIZED-IN CROSS-LINKING AGENTS, PROCESS FOR THEIR PREPARATION AND THEIR USE BASF AKTIENGESELLSCHAFT (DE) 1998-03-18 EP disclosed
EP-0828763-A1 POLYMER AND SURFACTANT MIXTURES, PROCESS FOR THEIR PREPARATION AND THEIR USE BASF AKTIENGESELLSCHAFT (DE) 1998-03-18 EP disclosed
EP-0765379-A1 COLOR MIGRATION INHIBITORS FOR WASHING AND CLEANING AGENTS BASF AKTIENGESELLSCHAFT (DE) 1997-04-02 EP disclosed
WO-1996037525-A1 WATER-SOLUBLE COPOLYMERS CONTAINING POLYMERIZED-IN CROSS-LINKING AGENTS, PROCESS FOR THEIR PREPARATION AND THEIR USE BASF AKTIENGESELLSCHAFT (DE) 1996-11-28 WO disclosed
WO-1996037598-A1 DYE TRANSFER INHIBITORS FOR DETERGENTS CONTAINING BLEACHING AGENTS BASF AKTIENGESELLSCHAFT (DE) 1996-11-28 WO disclosed
WO-1996037524-A1 POLYMER AND SURFACTANT MIXTURES, PROCESS FOR THEIR PREPARATION AND THEIR USE BASF AKTIENGESELLSCHAFT (DE) 1996-11-28 WO disclosed
EP-0731813-A1 POLYMERS OF ALKYL-1-VINYLIMIDAZOLES BASF AG (DE) 1996-09-18 EP disclosed
WO-1995035360-A1 COLOR MIGRATION INHIBITORS FOR WASHING AND CLEANING AGENTS BASF AKTIENGESELLSCHAFT (DE) 1995-12-28 WO disclosed
WO-1995015345-A1 POLYMERS OF ALKYL-1-VINYLIMIDAZOLES BASF AKTIENGESELLSCHAFT (DE) 1995-06-08 WO disclosed