SCHEMBL11160263

SCHEMBL11160263

COc1ccccc1-c1ccccc1NC(N)=S

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.49
KMT2A Q03164 2/20 0.49
KDM4E B2RXH2 1/20 0.49
ALOX12 P18054 1/20 0.49
ALDH1A1 P00352 4/20 0.49
HPGD P15428 2/20 0.49
HTT P42858 2/20 0.49
L3MBTL1 Q9Y468 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.46
GRIN2D O15399 1/20 0.45
GRIN3B O60391 1/20 0.45
GRIN1 Q05586 1/20 0.45
GRIN2A Q12879 1/20 0.45
GRIN2B Q13224 1/20 0.45
GRIN2C Q14957 1/20 0.45
GRIN3A Q8TCU5 1/20 0.45
SIGMAR1 Q99720 1/20 0.45
GAA P10253 2/20 0.44
MAPT P10636 2/20 0.44
MEN1 O00255 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
SCHEMBL29654196 0.86 ALDH1A1 (0.64) LMNAKMT2AKDM4EALOX12ALDH1A1
SCHEMBL1396138 0.86 ALDH1A1 (0.64) LMNAKMT2AKDM4EALOX12ALDH1A1
Hydrochloric Acid SCHEMBL17782099 0.84 ALDH1A1 (0.62) LMNAKMT2AKDM4EALOX12ALDH1A1
SCHEMBL3719101 0.83 ALDH1A1 (0.46) LMNAKMT2AKDM4EALDH1A1HPGD
SCHEMBL5111603 0.78 ALDH1A1 (0.51) LMNAKMT2AKDM4EALDH1A1HPGD
SCHEMBL18550694 0.78 ALDH1A1 (0.47) LMNAKMT2AKDM4EALOX12ALDH1A1
SCHEMBL9311129 0.78 ALDH1A1 (0.58) LMNAKMT2AKDM4EALDH1A1L3MBTL1
SCHEMBL6028756 0.78 MEN1 (0.55) LMNAKMT2AALDH1A1HTTSMN1; SMN2
SCHEMBL11161401 0.77 ALDH1A1 (0.53) LMNAKMT2AKDM4EALOX12ALDH1A1
SCHEMBL11162854 0.77 EPHX1 (0.64) LMNAKMT2AKDM4EALOX12ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0017484-B1 2-IMIDAZOLINE DERIVATIVES, PROCESS FOR THE PREPARATION THEREOF AND THE PHARMACEUTICAL COMPOSITION OF THE SAME FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1983-04-06 EP disclosed
EP-0017484-A1 2-Imidazoline derivatives, process for the preparation thereof and the pharmaceutical composition of the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1980-10-15 EP disclosed