SCHEMBL11468229

SCHEMBL11468229

C#CCN(C)Cc1cc(C)c(CSCCN)o1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PRMT6 Q96LA8 1/20 0.42
PYCR1 P32322 16/20 0.39
LMNA P02545 2/20 0.34
MAOB P27338 2/20 0.34
USP2 O75604 1/20 0.34
CYP3A4 P08684 1/20 0.34
TSHR P16473 1/20 0.34
MAOA P21397 1/20 0.34
ALDH1A1 P00352 1/20 0.33
BLM P54132 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL11460483 0.85 PRMT6 (0.44) PRMT6
SCHEMBL10959685 0.84 PRMT6 (0.59) PRMT6
SCHEMBL10960228 0.80 PRMT6 (0.67) PRMT6PYCR1LMNAMAOBUSP2
SCHEMBL11479765 0.79 PRMT6 (0.42) PRMT6ALDH1A1
SCHEMBL10957232 0.75 PRMT6 (0.59) PRMT6
SCHEMBL11477311 0.74 BCHE (0.49)
SCHEMBL11477315 0.74 BCHE (0.49)
SCHEMBL11478593 0.73 ACHE (0.47) PYCR1LMNATSHRBLM
SCHEMBL11460057 0.72 PRMT6 (0.38) PRMT6
SCHEMBL7995058 0.72 PRMT6 (0.43) PRMT6CYP3A4

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
US-4203909-A ANTIULCER BRISTOL-MYERS COMPANY (US) 1980-05-20 US disclosed