SCHEMBL7168073

SCHEMBL7168073

Cc1ccc2c(c1)N(C(C)CCO)c1ccccc1CC2

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.40
POLB P06746 2/20 0.40
TP53 P04637 1/20 0.40
MAPT P10636 1/20 0.40
KMT2A Q03164 6/20 0.38
MEN1 O00255 5/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
TSHR P16473 2/20 0.36
SLC6A2 P23975 2/20 0.36
SLC6A4 P31645 2/20 0.36
SLC22A1 O15245 1/20 0.36
CHRM2 P08172 1/20 0.36
HTR1A P08908 1/20 0.36
ADRA2A P08913 1/20 0.36
CHRM1 P11229 1/20 0.36
DRD1 P21728 1/20 0.36
TBXA2R P21731 1/20 0.36
ADRA1A P35348 1/20 0.36
OPRM1 P35372 1/20 0.36
DRD3 P35462 1/20 0.36

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
SCHEMBL5495301 0.77 SLC6A1 (0.42) TP53DRD3KCNH2ALDH1A1
SCHEMBL20118737 0.76 ALDH1A1 (0.41) MAPTKMT2AMEN1TSHRKCNH2
Hydrochloric Acid SCHEMBL7163639 0.76 SLC6A1 (0.41) TP53DRD3KCNH2ALDH1A1
SCHEMBL7168069 0.74 MTNR1A (0.46) LMNAPOLBTP53MAPTKMT2A
SCHEMBL7167706 0.74 ALDH1A1 (0.48) LMNAMAPTKMT2AMEN1L3MBTL1
SCHEMBL6963720 0.72 HTR2A (0.53) LMNATP53MAPTKMT2AMEN1
SCHEMBL13057486 0.71 SLC6A2 (0.46) LMNAPOLBMAPTKMT2AMEN1
SCHEMBL13485712 0.70 SLC6A2 (0.44) LMNAPOLBTP53MAPTKMT2A
SCHEMBL13456561 0.70 ALDH1A1 (0.42) LMNAPOLBTP53MAPTKMT2A
SCHEMBL25784150 0.67 KDM4E (0.66) POLBMAPTKMT2AMEN1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6569849-B1 N-Substituted azaheterocyclic compounds NOVO NORDISK A/S (DK) 2003-05-27 US disclosed
EP-0934306-A1 N-SUBSTITUTED AZAHETEROCYCLIC COMPOUNDS NOVO NORDISK A/S (DK) 1999-08-11 EP disclosed
WO-1998015546-A1 N-SUBSTITUTED AZAHETEROCYCLIC COMPOUNDS NOVO NORDISK A/S (DK) 1998-04-16 WO disclosed