SCHEMBL5058804

SCHEMBL5058804

[CH2]CN1CCC(C(N)=O)C1

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.55
BCHE P06276 1/20 0.45
GAA P10253 4/20 0.43
LTA4H P09960 1/20 0.42
KDM4E B2RXH2 2/20 0.40
KMT2A Q03164 1/20 0.39
ALDH1A1 P00352 4/20 0.38
MAPK1 P28482 1/20 0.38
SMYD3 Q9H7B4 1/20 0.38
LMNA P02545 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
SCHEMBL17977267 0.83
SCHEMBL1361559 0.82 S1PR5 (0.43) SMN1; SMN2ALDH1A1LMNA
SCHEMBL24952583 0.80 SMN1; SMN2 (0.78) SMN1; SMN2BCHEGAALTA4HKDM4E
SCHEMBL12635335 0.80 SMN1; SMN2 (0.55) SMN1; SMN2BCHEGAALTA4HKDM4E
SCHEMBL12635333 0.80 SMN1; SMN2 (0.55) SMN1; SMN2BCHEGAALTA4HKDM4E
SCHEMBL23557639 0.80 SMN1; SMN2 (0.78) SMN1; SMN2BCHEGAALTA4HKDM4E
SCHEMBL12524456 0.80 SMN1; SMN2 (0.78) SMN1; SMN2BCHEGAALTA4HKDM4E
SCHEMBL14315095 0.78 SMN1; SMN2 (0.53) SMN1; SMN2BCHEGAALTA4HKDM4E
SCHEMBL23855249 0.78 SMN1; SMN2 (0.53) SMN1; SMN2BCHEGAALTA4H
SCHEMBL4730783 0.78 SMN1; SMN2 (0.53) SMN1; SMN2BCHEGAALTA4H

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-2008007835-A1 2,4-QUINAZOLINE DERIVATIVES HAVING ACTIVITY TO T-TYPE CALCIUM CHANNEL AND PREPARATION METHOD THEREOF KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2008-01-17 WO disclosed