SCHEMBL8714399

SCHEMBL8714399

CCC(C)NC(=O)c1n[nH]c2ccccc12

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 2/20 0.74
▸ MEN1 O00255 1/20 0.74
▸ KMT2A Q03164 1/20 0.74
▸ L3MBTL1 Q9Y468 1/20 0.74
▸ YTHDC1 Q96MU7 1/20 0.62
▸ DYRK1A Q13627 2/20 0.61
▸ KDM4E B2RXH2 4/20 0.60
▸ SMN1; SMN2 Q16637 3/20 0.60
▸ ALDH1A1 P00352 2/20 0.56
▸ FLT3 P36888 4/20 0.56
▸ CCNA2 P20248 1/20 0.56
▸ CDK2 P24941 1/20 0.56
▸ CCNA1 P78396 1/20 0.56
▸ STAT3 P40763 1/20 0.55
▸ HIF1A Q16665 1/20 0.55
▸ IDO1 P14902 1/20 0.53
▸ CYP1A2 P05177 1/20 0.53
▸ NPC1 O15118 2/20 0.53
▸ RAB9A P51151 2/20 0.53
▸ EPHB3 P54753 1/20 0.51

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
SCHEMBL18851945 0.88 YTHDC1 (0.61) HTTMEN1KMT2AL3MBTL1YTHDC1
SCHEMBL2704442 0.85 SMN1; SMN2 (0.71) YTHDC1DYRK1AKDM4ESMN1; SMN2ALDH1A1
SCHEMBL31445444 0.84 YTHDC1 (0.59) HTTMEN1KMT2AL3MBTL1YTHDC1
Oxalic Acid SCHEMBL7429480 0.82 SMN1; SMN2 (0.66) YTHDC1DYRK1AKDM4ESMN1; SMN2ALDH1A1
SCHEMBL18851791 0.80 YTHDC1 (0.51) HTTMEN1KMT2AL3MBTL1YTHDC1
SCHEMBL18851649 0.80 YTHDC1 (0.51) HTTMEN1KMT2AL3MBTL1YTHDC1
SCHEMBL18851943 0.80 YTHDC1 (0.51) HTTMEN1KMT2AL3MBTL1YTHDC1
SCHEMBL18851928 0.80 YTHDC1 (0.51) HTTMEN1KMT2AL3MBTL1YTHDC1
SCHEMBL12844148 0.79 YTHDC1 (0.56) HTTMEN1KMT2AL3MBTL1YTHDC1
SCHEMBL19884728 0.78 YTHDC1 (0.59) YTHDC1KDM4ESMN1; SMN2FLT3CCNA2

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-0708105-B1 5-HT4 receptor agonists NISSHIN FLOUR MILLING CO (JP) 1998-12-23 — — EP claimed
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