SCHEMBL6141114

SCHEMBL6141114

CN(C)CCN(C)Cc1ccccc1CC=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.49
TNNI3 P19429 1/20 0.49
TNNT2 P45379 1/20 0.49
TNNC1 P63316 1/20 0.49
KMT2A Q03164 1/20 0.49
ALDH1A1 P00352 3/20 0.44
NPSR1 Q6W5P4 2/20 0.44
MAPT P10636 2/20 0.44
LMNA P02545 1/20 0.44
MAPK1 P28482 1/20 0.44
RAD52 P43351 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
ADORA2A P29274 1/20 0.40
ADORA1 P30542 1/20 0.40
CHRM2 P08172 2/20 0.38
TSHR P16473 1/20 0.38
ATM Q13315 1/20 0.38
TAAR1 Q96RJ0 3/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2D6 P10635 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
SCHEMBL8677186 0.83 SLC6A4 (0.43) MEN1KMT2AALDH1A1LMNASMN1; SMN2
SCHEMBL5915657 0.79 MEN1 (0.49) MEN1TNNI3TNNT2TNNC1KMT2A
SCHEMBL6141524 0.76 TAAR1 (0.37) MEN1TNNI3TNNT2TNNC1KMT2A
SCHEMBL11638292 0.74 MEN1 (0.55) MEN1TNNI3TNNT2TNNC1KMT2A
SCHEMBL7461135 0.74 TDP1 (0.38) MEN1KMT2AALDH1A1LMNAMAPK1
SCHEMBL6141142 0.74 SCN1A (0.34) MEN1KMT2AATMCYP1A2CYP2D6
SCHEMBL12858626 0.73 MEN1 (0.53) MEN1TNNI3TNNT2TNNC1KMT2A
SCHEMBL29547081 0.73 MEN1 (0.53) MEN1TNNI3TNNT2TNNC1KMT2A
SCHEMBL16983643 0.72 MEN1 (0.49) MEN1TNNI3TNNT2TNNC1KMT2A
SCHEMBL3693598 0.71 MEN1 (0.47) MEN1TNNI3TNNT2TNNC1KMT2A

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1515940-A2 AMINOALKOXY-FUNCTIONAL CHALCONES Lica Pharmaceuticals A/S (DK) 2005-03-23 EP disclosed
EP-1506157-A2 AMINO-FUNCTIONAL CHALCONES Lica Pharmaceuticals A/S (DK) 2005-02-16 EP disclosed
EP-1506158-A2 DIAMINO-FUNCTIONAL CHALCONES Lica Pharmaceuticals A/S (DK) 2005-02-16 EP disclosed
WO-2003097576-A2 DIAMINO-FUNCTIONAL CHALCONES LICA PHARMACEUTICALS A/S (DK) 2003-11-27 WO disclosed
WO-2003097574-A2 AMINOALKOXY-FUNCTIONAL CHALCONES LICA PHARMACEUTICALS A/S (DK) 2003-11-27 WO disclosed
WO-2003097575-A2 AMINO-FUNCTIONAL CHALCONES LICA PHARMACEUTICALS A/S (DK) 2003-11-27 WO disclosed