SCHEMBL30409688

SCHEMBL30409688

Cc1cccc2[nH]nnc12.[N]

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MGAM O43451 14/20 0.39
GAA P10253 14/20 0.39
SI P14410 14/20 0.39
MGAM2 Q2M2H8 14/20 0.39
ESR1 P03372 1/20 0.37
CBFB Q13951 1/20 0.37

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
SCHEMBL28273348 0.98 MGAM (0.40) MGAMGAASIMGAM2ESR1
SCHEMBL107037 0.98 MGAM (0.40) MGAMGAASIMGAM2ESR1
SCHEMBL1151658 0.96 MGAM (0.39) MGAMGAASIMGAM2ESR1
SCHEMBL31047175 0.96 MGAM (0.39) MGAMGAASIMGAM2ESR1
Hydrochloric Acid SCHEMBL29144458 0.96 MGAM (0.39) MGAMGAASIMGAM2ESR1
SCHEMBL3673453 0.96 MGAM (0.39) MGAMGAASIMGAM2ESR1
SCHEMBL4114531 0.96 MGAM (0.39) MGAMGAASIMGAM2ESR1
SCHEMBL1537872 0.96 MGAM (0.39) MGAMGAASIMGAM2ESR1
SCHEMBL1817180 0.96 MGAM (0.39) MGAMGAASIMGAM2ESR1
Potassium SCHEMBL29530834 0.96 MGAM (0.39) MGAMGAASIMGAM2ESR1

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-116179246-A Methanol fuel additive and preparation method thereof 山东科信石油化工有限公司 2023-05-30 CN disclosed