SCHEMBL3427273

SCHEMBL3427273

Cn1nccc1OC(=O)O

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.40
HTT P42858 2/20 0.39
SSTR4 P31391 1/20 0.37
MAPK1 P28482 1/20 0.37
KMT2A Q03164 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
KDM5A P29375 1/20 0.36
KDM4C Q9H3R0 1/20 0.36
KDM5B Q9UGL1 1/20 0.36
NPC1 O15118 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C19 P33261 1/20 0.36
RAB9A P51151 1/20 0.36
ALDH1A1 P00352 3/20 0.35
TSHR P16473 1/20 0.35
HSD17B10 Q99714 1/20 0.35
GPR52 Q9Y2T5 1/20 0.35
NAMPT P43490 1/20 0.34

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
SCHEMBL27359663 0.84 HTT (0.42) SMN1; SMN2HTTSSTR4KMT2AL3MBTL1
SCHEMBL23141464 0.82 SMN1; SMN2 (0.39) SMN1; SMN2HTTSSTR4KMT2AL3MBTL1
SCHEMBL21570110 0.76 SMN1; SMN2 (0.43) SMN1; SMN2SSTR4MAPK1KMT2AL3MBTL1
SCHEMBL3417583 0.74 POLB (0.50) SMN1; SMN2MAPK1KMT2AKDM5AKDM4C
SCHEMBL28293147 0.74 SMN1; SMN2 (0.34) SMN1; SMN2HTTSSTR4KMT2AL3MBTL1
SCHEMBL1357600 0.73
SCHEMBL24159298 0.71 SSTR4 (0.42) HTTSSTR4KMT2AL3MBTL1ALDH1A1
SCHEMBL10959724 0.70 MAPT (0.53) SMN1; SMN2KMT2AL3MBTL1NPC1CYP1A2
SCHEMBL23158215 0.70
SCHEMBL16303536 0.69

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
EP-2988321-B1 CLEANING LIQUID COMPOSITION KANTO KAGAKU (JP) 2019-03-20 EP claimed
WO-2010051926-A2 NEW HALOGEN-SUBSTITUTED BONDS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2010-05-14 WO disclosed
EP-0023707-B1 SUBSTITUTED TETRAAZATRICYCLIC COMPOUNDS, PROCESS FOR THEIR PREPARATION, THEIR USE AND MEDICINES CONTAINING THEM Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 1986-04-30 EP disclosed
EP-0066774-B1 1,4,9,10-TETRAHYDROPYRAZOLO(4,3-E)PYRIDO(3,2-B)(1,4)DIAZEPIN-10-ONES, PROCESS FOR THEIR PREPARATION AND MEDICINAL PREPARATIONS CONTAINING THEM Dr. Karl Thomae GmbH (DE) 1984-12-12 EP disclosed
EP-0066774-A1 1,4,9,10-Tetrahydropyrazolo(4,3-e)pyrido(3,2-b)(1,4)diazepin-10-ones, process for their preparation and medicinal preparations containing them Dr. Karl Thomae GmbH (DE) 1982-12-15 EP disclosed
EP-0064775-A1 Substituted tetraazatricyclic compounds, process for their preparation and their use Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 1982-11-17 EP disclosed
EP-0023707-A1 Substituted tetraazatricyclic compounds, process for their preparation, their use and medicines containing them Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 1981-02-11 EP disclosed