SCHEMBL29465738

SCHEMBL29465738

ClC1=NC=C1N1CCOCC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2D6 P10635 1/20 0.43
ALOX15 P16050 1/20 0.40
HTT P42858 2/20 0.39
NPSR1 Q6W5P4 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
GAA P10253 2/20 0.38
TP53 P04637 1/20 0.38
STAT3 P40763 1/20 0.38
LMNA P02545 1/20 0.38
POLB P06746 1/20 0.37
KMT2A Q03164 2/20 0.37
KDM4E B2RXH2 2/20 0.37
MEN1 O00255 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
MAPK1 P28482 1/20 0.36
CRHBP P24387 1/20 0.36
CRHR2 Q13324 1/20 0.36

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
SCHEMBL5170761 0.63 MAPT (0.37) MAPTCYP1A2CYP2D6HTTSMN1; SMN2
SCHEMBL1735480 0.62 CNR2 (0.55) MAPTCYP1A2ALOX15HTTSMN1; SMN2
SCHEMBL856718 0.62 MAPT (0.61) MAPTCYP1A2CYP2D6HTTNPSR1
SCHEMBL17204101 0.62 MAPT (0.61) MAPTCYP1A2CYP2D6HTTNPSR1
SCHEMBL17673774 0.62 MAPT (0.56) MAPTCYP1A2CYP2D6HTTNPSR1
SCHEMBL23467846 0.62 POLB (0.58) CYP1A2HTTNPSR1POLBKMT2A
SCHEMBL3996473 0.62 MAPT (0.56) MAPTCYP1A2CYP2D6ALOX15HTT
SCHEMBL1617856 0.62 MAPT (0.56) MAPTCYP1A2CYP2D6HTTNPSR1
SCHEMBL21690 0.62 MAPT (0.66) MAPTCYP1A2ALOX15HTTSMN1; SMN2
SCHEMBL9508287 0.62 MAPT (0.66) MAPTCYP1A2HTTSMN1; SMN2TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3983413-A1 SUBSTITUTED PYRAZOLO-PYRAZINES AND THEIR USE AS GLUN2B RECEPTOR MODULATORS Janssen Pharmaceutica NV (BE) 2022-04-20 EP disclosed