SCHEMBL7119993

SCHEMBL7119993

CCCCN=Cc1cccnc1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.55
FAAH O00519 9/20 0.48
SMN1; SMN2 Q16637 4/20 0.47
NPC1 O15118 2/20 0.47
LMNA P02545 2/20 0.47
MAPT P10636 2/20 0.47
RAB9A P51151 1/20 0.47
CYP2C9 P11712 1/20 0.46
HPGD P15428 1/20 0.46
CYP2C19 P33261 1/20 0.46
TDP1 Q9NUW8 2/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
G6PC1 P35575 1/20 0.44
GAA P10253 1/20 0.44
GFER P55789 1/20 0.44

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
SCHEMBL7119990 1.00 ALDH1A1 (0.55) ALDH1A1FAAHSMN1; SMN2NPC1LMNA
SCHEMBL7664431 0.90 ALDH1A1 (0.58) ALDH1A1SMN1; SMN2NPC1LMNAMAPT
SCHEMBL7664429 0.90 ALDH1A1 (0.58) ALDH1A1SMN1; SMN2NPC1LMNAMAPT
SCHEMBL4253299 0.86 ALDH1A1 (0.67) ALDH1A1SMN1; SMN2NPC1LMNAMAPT
SCHEMBL4253302 0.86 ALDH1A1 (0.67) ALDH1A1SMN1; SMN2NPC1LMNAMAPT
SCHEMBL7665538 0.82 ALDH1A1 (0.62) ALDH1A1SMN1; SMN2NPC1LMNAMAPT
SCHEMBL7665544 0.82 ALDH1A1 (0.62) ALDH1A1SMN1; SMN2NPC1LMNAMAPT
SCHEMBL4253696 0.81 ALDH1A1 (0.60) ALDH1A1SMN1; SMN2NPC1LMNAMAPT
SCHEMBL4253702 0.81 ALDH1A1 (0.60) ALDH1A1SMN1; SMN2NPC1LMNAMAPT
SCHEMBL6587578 0.80 TAAR1 (0.59) ALDH1A1MAPTTDP1L3MBTL1G6PC1

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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1038866-B1 Process for producing aziridine compound DAICEL CHEM (JP) 2003-11-12 EP disclosed
US-6407248-B1 INSECTICIDES, MITICIDES TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2002-06-18 US disclosed
CN-1083432-C Alpha-unsaturated amines, their production and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2002-04-24 CN disclosed
US-6323346-B1 REACTING A DIAZOACETIC ACID DERIVATIVE OF THE FORMULA N.SUB.2 CHR.SUP.4 WITH A CARBONYL COMPOUND OF FORMULA R.SUP.1 R.SUP.2 C.DBD.O AND AN AMINO-GROUP-CONTAINING COMPOUND OF FORMULA R.SUP.3 NH.SUB.2 IN THE PRESENCE OF AN IRIDIUM COMPLEX DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2001-11-27 US disclosed
EP-1038866-A1 Process for producing aziridine compound Daicel Chemical Industries, Ltd. (JP) 2000-09-27 EP disclosed
US-6124297-A COMBATTING INSECTS OR MITES TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2000-09-26 US disclosed
US-5935981-A INSECTICIDAL/MITICIDAL ACTIVITY TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1999-08-10 US disclosed
US-5849768-A α-unsaturated amines, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-12-15 US disclosed
EP-0529680-B1 Intermediates, their production and their use for preparing alpha-unsaturated amines TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1998-05-13 EP disclosed
CN-1036649-C Alpha-unsaturated amines, their production and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1997-12-10 CN disclosed
EP-0302389-B1 Alpha-unsaturated amines, their production and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1993-12-22 EP disclosed
US-5252741-A Processes for the synthesis of imines, aldehydes, and unsymmetrical secondary amines REILLY INDUSTRIES, INC. (US) 1993-10-12 US disclosed
EP-0548233-A1 PROCESSES FOR THE SYNTHESIS OF IMINES, ALDEHYDES, AND UNSYMMETRICAL SECONDARY AMINES. REILLY IND INC (US) 1993-06-30 EP disclosed
US-5214152-A Insecticides, miticides TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1993-05-25 US disclosed
EP-0529680-A2 Intermediates, their production and their use for preparing alpha-unsaturated amines TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1993-03-03 EP disclosed
US-5175301-A Insecticide, miticide, pesticide TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1992-12-29 US disclosed
EP-0509559-A2 Alpha-unsaturated amines, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1992-10-21 EP disclosed
WO-1992002507-A1 PROCESSES FOR THE SYNTHESIS OF IMINES, ALDEHYDES, AND UNSYMMETRICAL SECONDARY AMINES REILLY INDUSTRIES, INC. (US) 1992-02-20 WO disclosed
CN-1031079-A Alpha-unsaturated amines, process for their production and their use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1989-02-15 CN disclosed
EP-0302389-A2 Alpha-unsaturated amines, their production and use Takeda Chemical Industries, Ltd. (JP) 1989-02-08 EP disclosed