SCHEMBL9687804

SCHEMBL9687804

[CH2]c1c(C)cccc1NCc1ccncc1

nearest known ligand 0.71

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ADRA2C P18825 2/20 0.71
HTT P42858 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
GAA P10253 2/20 0.49
ABCB1 P08183 1/20 0.44
POLB P06746 3/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
MAPK1 P28482 1/20 0.43
KMT2A Q03164 1/20 0.42
KDR P35968 1/20 0.40
NAMPT P43490 1/20 0.40
KCNH3 Q9ULD8 1/20 0.40
VNN1 O95497 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
MAPT P10636 1/20 0.39
TDP1 Q9NUW8 1/20 0.39

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
SCHEMBL1715510 0.76 ADRA2C (0.63) ADRA2CHTTSMN1; SMN2NPSR1GAA
SCHEMBL17131815 0.70 SMN1; SMN2 (0.60) ADRA2CHTTSMN1; SMN2NPSR1POLB
SCHEMBL4979656 0.70 ADRA2C (0.67) ADRA2CHTTMAPK1KMT2AKDR
SCHEMBL5718602 0.70 KDM4C (0.56) ADRA2CHTTSMN1; SMN2NPSR1POLB
SCHEMBL30894547 0.69 ADRA2C (0.64) ADRA2CHTTSMN1; SMN2NPSR1ABCB1
SCHEMBL3884069 0.69 ADRA2C (0.64) ADRA2CHTTSMN1; SMN2NPSR1ABCB1
SCHEMBL28111178 0.69 ADRA2C (0.64) ADRA2CHTTSMN1; SMN2NPSR1ABCB1
SCHEMBL9685614 0.69 LMNA (0.56) HTTSMN1; SMN2NPSR1GAAPOLB
Hydrochloric Acid SCHEMBL3874671 0.68 ADRA2C (0.62) ADRA2CHTTSMN1; SMN2NPSR1ABCB1
SCHEMBL9687830 0.68 HTT (0.47) HTTSMN1; SMN2NPSR1POLBL3MBTL1

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-0268989-B1 IMIDAZOPYRIDINE COMPOUNDS AND PROCESSES FOR PREPARATION THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-07-08 EP claimed