SCHEMBL9802333

SCHEMBL9802333

Nc1ccc(-n2ccnc2[S+]([O-])Cc2ccccc2N2CCOCC2)nc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.35
MEN1 O00255 1/20 0.35
LMNA P02545 1/20 0.35
PKM P14618 1/20 0.35
KMT2A Q03164 1/20 0.35
GRIN2D O15399 1/20 0.33
GRIN3B O60391 1/20 0.33
GRIN1 Q05586 1/20 0.33
GRIN2A Q12879 1/20 0.33
GRIN2B Q13224 1/20 0.33
GRIN2C Q14957 1/20 0.33
GRIN3A Q8TCU5 1/20 0.33
BRD4 O60885 1/20 0.32
BRD9 Q9H8M2 1/20 0.32
CYP1A2 P05177 1/20 0.32
POLB P06746 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.32

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
SCHEMBL9011975 0.87 ALDH1A1 (0.37) KDM4EMEN1LMNAPKMKMT2A
SCHEMBL9802383 0.82 RAB9A (0.43) KDM4ELMNACYP1A2POLBCYP2C19
SCHEMBL9802799 0.78 CYP1A2 (0.39) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL9803069 0.77
SCHEMBL9802871 0.72 SMN1; SMN2 (0.38) KDM4EMEN1LMNAKMT2ACYP1A2
SCHEMBL9665360 0.69 KDM4E (0.34) KDM4EPOLBALDH1A1
SCHEMBL9666990 0.69 KDM4E (0.35) KDM4EPOLBALDH1A1
SCHEMBL48764 0.67 ALDH1A1 (0.55) KDM4EMEN1LMNAKMT2AGRIN2D
SCHEMBL29536679 0.67 ALDH1A1 (0.55) KDM4EMEN1LMNAKMT2AGRIN2D
SCHEMBL9803102 0.66 KDM4E (0.33) KDM4EMEN1LMNAPKMKMT2A

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
CN-1020902-C IMIDAZOLE DERIVATIVE AND PROCESSES FOR PREPARING SAME TANAHBE SEIYAKU CO LTD (JP) 1993-05-26 CN disclosed
US-5053417-A Antiulcer agents TANABE SEIYAKU CO., LTD. (JP) 1991-10-01 US disclosed
US-5002945-A Antiulcer agents TANABE SEIYAKU CO. LTD. (JP) 1991-03-26 US disclosed
US-4996217-A Antiulcer agents TANABE SEIYAKU COMPANY, LTD. (JP) 1991-02-26 US disclosed
CN-87108111-A Novel imidazole derivative and preparation method thereof 1988-09-28 CN disclosed
EP-0270091-A1 Imidazole derivatives, processes for the preparation of the same, pharmaceutical compositions comprising the same, the use of the same for the manufacture of medicaments of therapeutic value, and intermediates formed during said processes TANABE SEIYAKU CO., LTD. (JP) 1988-06-08 EP disclosed