SCHEMBL11230485

SCHEMBL11230485

CCOCn1ccnc1C(=CCN1CCCC1)c1ccc(C)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.54
SLC6A4 P31645 3/20 0.54
ADRA1A P35348 2/20 0.54
HRH1 P35367 2/20 0.54
OPRK1 P41145 2/20 0.54
ADRA2B P18089 2/20 0.54
ALDH1A1 P00352 2/20 0.54
CHRM1 P11229 1/20 0.54
KCNH2 Q12809 1/20 0.54
MEN1 O00255 1/20 0.54
CYP2D6 P10635 1/20 0.54
TSHR P16473 1/20 0.54
NFKB1 P19838 1/20 0.54
THPO P40225 1/20 0.54
KMT2A Q03164 1/20 0.54
NPSR1 Q6W5P4 2/20 0.53
GMNN O75496 1/20 0.53
BLM P54132 1/20 0.53
PMP22 Q01453 1/20 0.53
PTGS2 P35354 1/20 0.42

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
SCHEMBL11230464 1.00 LMNA (0.54) LMNASLC6A4ADRA1AHRH1OPRK1
SCHEMBL11233121 0.74 PPARG (0.45) LMNAALDH1A1NFKB1KMT2ANPSR1
Triprolidine SCHEMBL3881294 0.70 KMT2A (1.00) LMNASLC6A4ADRA1AHRH1OPRK1
Triprolidine SCHEMBL29631820 0.70 KMT2A (1.00) LMNASLC6A4ADRA1AHRH1OPRK1
Triprolidine SCHEMBL4906 0.70 KMT2A (1.00) LMNASLC6A4ADRA1AHRH1OPRK1
Triprolidine SCHEMBL4905 0.70 KMT2A (1.00) LMNASLC6A4ADRA1AHRH1OPRK1
Triprolidine SCHEMBL1141100 0.70 SLC6A4 (0.93) LMNASLC6A4ADRA1AHRH1OPRK1
Triprolidine SCHEMBL42145 0.69 LMNA (1.00) LMNASLC6A4ADRA1AHRH1OPRK1
SCHEMBL11234661 0.69 LMNA (0.61) LMNASLC6A4ADRA1AHRH1OPRK1
Triprolidine SCHEMBL3273486 0.69 KMT2A (0.97) LMNASLC6A4ADRA1AHRH1OPRK1

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-4324792-A SKIN DISORDERS, HAY FEVER, ASTHMA GLAXO GROUP LIMITED (GB) 1982-04-13 US disclosed