SCHEMBL20076959

SCHEMBL20076959

Cc1cnc2ccc(N)c(C#N)c2n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.38
ALDH1A1 P00352 5/20 0.35
HPGD P15428 3/20 0.35
HSD17B10 Q99714 3/20 0.35
HTT P42858 3/20 0.34
POLB P06746 2/20 0.34
LMNA P02545 1/20 0.34
NCOA1 Q15788 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
HIF1A Q16665 1/20 0.34
NCOA3 Q9Y6Q9 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
NPSR1 Q6W5P4 2/20 0.33
PPARG P37231 1/20 0.33
STAT3 P40763 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
NR2E3 Q9Y5X4 1/20 0.33
NCOR2 Q9Y618 1/20 0.33
CDK4 P11802 1/20 0.33
CCND3 P30281 1/20 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
SCHEMBL27146477 0.71 CSF1R (0.39) KDM4EALDH1A1HPGDHSD17B10LMNA
SCHEMBL3583880 0.70 KDM4E (0.49) KDM4EALDH1A1HPGDHSD17B10POLB
SCHEMBL6420817 0.70 NR1H2 (0.40) KDM4EHTTSMN1; SMN2TDP1NPSR1
Hydrochloric Acid SCHEMBL3581051 0.69 KDM4E (0.47) KDM4EALDH1A1HPGDHSD17B10POLB
SCHEMBL12814344 0.69 MEN1 (0.51) KDM4EALDH1A1HTTPOLBLMNA
SCHEMBL1031945 0.68 MAPT (0.38) KDM4EALDH1A1POLBLMNA
SCHEMBL20077346 0.68 MAPT (0.38) KDM4EALDH1A1HSD17B10HTTPOLB
SCHEMBL10277395 0.67 MAPT (0.40) KDM4EALDH1A1HSD17B10HTTPOLB
SCHEMBL15979212 0.67 RAB9A (0.38) KDM4EALDH1A1HPGDPOLBSMN1; SMN2
SCHEMBL26194060 0.66 MAPT (0.48) KDM4EALDH1A1LMNASMN1; SMN2ADRA2A

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
WO-2018071348-A1 QUINOXALINE COMPOUNDS AS TYPE III RECEPTOR TYROSINE KINASE INHIBITORS DEVELOPMENT CENTER FOR BIOTECHNOLOGY (TW) 2018-04-19 WO disclosed