SCHEMBL28544166

SCHEMBL28544166

CCCCCCCCC1(C)N=c2ccccc2=N1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 5/20 0.39
MMP9 P14780 5/20 0.39
MMP3 P08254 1/20 0.39
GAA P10253 3/20 0.39
MEN1 O00255 1/20 0.39
ALOX12 P18054 1/20 0.39
KMT2A Q03164 1/20 0.39
MMP8 P22894 2/20 0.38
MMP13 P45452 2/20 0.38
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 2/20 0.38
MAPT P10636 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
KCNH2 Q12809 1/20 0.37
SLC9A1 P19634 3/20 0.37
OPRM1 P35372 1/20 0.35
OPRD1 P41143 1/20 0.35
OPRK1 P41145 1/20 0.35
OPRL1 P41146 1/20 0.35
LIPG Q9Y5X9 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
SCHEMBL14361626 1.00 MMP2 (0.39) MMP2MMP9MMP3GAAMEN1
SCHEMBL14361832 1.00 MMP2 (0.39) MMP2MMP9MMP3GAAMEN1
SCHEMBL14361651 0.92 ELANE (0.35) GAAMEN1ALOX12KMT2AKDM4E
SCHEMBL14361737 0.84 KDM1A (0.32) KMT2AKDM4EALDH1A1MAPT
SCHEMBL15578898 0.82 MMP2 (0.40) MMP2MMP9MMP3GAAMEN1
SCHEMBL14361695 0.82 MMP2 (0.40) MMP2MMP9MMP3GAAMEN1
SCHEMBL11270919 0.82 MMP2 (0.40) MMP2MMP9MMP3GAAMEN1
SCHEMBL9406703 0.80 TDP1 (0.33) ALOX12KDM4ESMN1; SMN2
SCHEMBL14361783 0.79 MMP2 (0.38) MMP2MMP9MMP3GAAMEN1
SCHEMBL14361610 0.77 MMP2 (0.36) MMP2MMP9MMP3GAAMEN1

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
CN-110087823-B Flux and resin composition for flux 千住金属工业株式会社 2021-04-27 CN disclosed