SCHEMBL30165231

SCHEMBL30165231

CSc1ncc(F)c(Cl)n1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
MAPT P10636 3/20 0.35
LMNA P02545 3/20 0.35
ALDH1A1 P00352 2/20 0.35
AHR P35869 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
KDM4E B2RXH2 1/20 0.35
HASPIN Q8TF76 1/20 0.34
RPS6KA5 O75582 1/20 0.34
GAA P10253 2/20 0.33
NPC1 O15118 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
HTT P42858 1/20 0.33
CCNA2 P20248 2/20 0.33
CDK2 P24941 2/20 0.33

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
SCHEMBL5416326 1.00 MEN1 (0.44) MEN1KMT2AMAPTLMNAALDH1A1
SCHEMBL2714124 0.78 KMT2A (0.56) MEN1KMT2AMAPTLMNAALDH1A1
SCHEMBL6073354 0.78 MEN1 (0.38) MEN1KMT2AMAPTLMNAALDH1A1
SCHEMBL9153248 0.77 MEN1 (0.38) MEN1KMT2AMAPTLMNAALDH1A1
SCHEMBL3257090 0.77 KMT2A (0.46) MEN1KMT2AMAPTLMNAALDH1A1
SCHEMBL22648382 0.76 MEN1 (0.42) MEN1KMT2AMAPTLMNAALDH1A1
SCHEMBL5912611 0.76 AURKA (0.41) MEN1KMT2AMAPTLMNASMN1; SMN2
SCHEMBL19725082 0.75 MEN1 (0.49) MEN1KMT2AMAPTLMNAALDH1A1
SCHEMBL6524904 0.75 KMT2A (0.44) MEN1KMT2AMAPTLMNAALDH1A1
SCHEMBL1493979 0.75 KMT2A (0.44) MEN1KMT2AMAPTLMNAALDH1A1

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-4125845-A1 NOVEL 2-PYRIMIDONE ANALOGS AS POTENT ANTIVIRAL AGENTS AGAINST ALPHAVIRUSES Southern Research Institute (US) 2023-02-08 EP disclosed