SCHEMBL6289914

SCHEMBL6289914

CCC/N=C\c1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.64
ALDH1A1 P00352 2/20 0.64
CA2 P00918 6/20 0.53
LMNA P02545 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
TAAR1 Q96RJ0 3/20 0.47
CA1 P00915 3/20 0.45
CA12 O43570 3/20 0.45
CA9 Q16790 2/20 0.45
G6PC1 P35575 1/20 0.39
NOX1 Q9Y5S8 1/20 0.39
MEN1 O00255 3/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
KDM4E B2RXH2 2/20 0.38
GRIN2D O15399 1/20 0.38
GRIN3B O60391 1/20 0.38
GRIN1 Q05586 1/20 0.38
GRIN2A Q12879 1/20 0.38
GRIN2B Q13224 1/20 0.38
GRIN2C Q14957 1/20 0.38

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
SCHEMBL7911619 1.00 KMT2A (0.64) KMT2AALDH1A1CA2LMNAL3MBTL1
SCHEMBL5235095 1.00 KMT2A (0.64) KMT2AALDH1A1CA2LMNAL3MBTL1
Dimethylamine SCHEMBL15367608 0.94 KMT2A (0.58) KMT2AALDH1A1CA2LMNAL3MBTL1
SCHEMBL5687699 0.88 ALDH1A1 (0.79) KMT2AALDH1A1CA2TAAR1CA1
SCHEMBL5687703 0.88 ALDH1A1 (0.79) KMT2AALDH1A1CA2TAAR1CA1
SCHEMBL1323651 0.87 CA2 (0.50) KMT2AALDH1A1CA2LMNAL3MBTL1
SCHEMBL1323649 0.87 CA2 (0.50) KMT2AALDH1A1CA2LMNAL3MBTL1
SCHEMBL845363 0.85 CA2 (0.61) KMT2AALDH1A1CA2LMNAL3MBTL1
SCHEMBL4256710 0.85 CA2 (0.61) KMT2AALDH1A1CA2LMNAL3MBTL1
SCHEMBL845362 0.85 CA2 (0.61) KMT2AALDH1A1CA2LMNAL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6867161-B1 Titanium catalyst and organotitanium reacting reagent, production thereof, and reaction thereby NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2005-03-15 US disclosed
EP-0714885-B1 Preparation process of aminoacetamide derivative EISAI CO LTD (JP) 1999-09-01 EP disclosed
EP-0820809-A1 TITANIUM CATALYST, ORGANOTITANIUM REACTION REAGENT, PROCESSES FOR PRODUCING THESE, AND METHOD OF REACTION USING THESE NISSAN CHEMICAL INDUSTRIES, LIMITED (JP) 1998-01-28 EP disclosed
EP-0714885-A2 Preparation process of aminoacetamide derivative EISAI CHEMICAL CO., LTD. (JP) 1996-06-05 EP disclosed
US-4357476-A Nonylamines CIBA GEIGY CORPORATION, N.Y. (US) 1982-11-02 US disclosed
US-4163024-A NICKEL CATALYST STUDIENGESELLSCHAFT KOHLE MBH. (DE) 1979-07-31 US disclosed
US-4139560-A Nonylamines CIBA GEIGY CORPORATION (US) 1979-02-13 US disclosed