SCHEMBL14515902

SCHEMBL14515902

Cc1c(N2CCCC2)c(F)cn2c(=O)c(C(=O)O)cc(C3CC3)c12

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SCN5A Q14524 1/20 0.40
KCNH2 Q12809 4/20 0.38
HPGD P15428 4/20 0.38
HSD17B10 Q99714 4/20 0.38
LMNA P02545 1/20 0.35
KDM4E B2RXH2 8/20 0.35
ALDH1A1 P00352 5/20 0.35
NOTUM Q6P988 1/20 0.34
ADRA2B P18089 1/20 0.34
MAPK1 P28482 1/20 0.34
ALB P02768 1/20 0.33
HRH3 Q9Y5N1 1/20 0.33
POLB P06746 1/20 0.33
HSP90AA1 P07900 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
TSHR P16473 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
SCHEMBL8566201 0.92 KDM4E (0.43) SCN5AKCNH2HPGDHSD17B10LMNA
SCHEMBL7499469 0.91 TOP1 (0.41) SCN5AKCNH2HPGDHSD17B10LMNA
SCHEMBL5279980 0.91 KDM4E (0.40) SCN5AKCNH2HPGDHSD17B10LMNA
Hydrochloric Acid SCHEMBL7506073 0.91 KDM4E (0.44) SCN5AKCNH2HPGDHSD17B10LMNA
SCHEMBL8601235 0.91 SCN5A (0.42) SCN5AKCNH2LMNAALDH1A1POLB
SCHEMBL8562588 0.90 ALDH1A1 (0.46) SCN5AKCNH2HPGDHSD17B10LMNA
SCHEMBL8566850 0.90 ALDH1A1 (0.46) SCN5AKCNH2HPGDHSD17B10LMNA
Hydrochloric Acid SCHEMBL7502813 0.90 KDM4E (0.39) SCN5AKCNH2HPGDHSD17B10LMNA
Hydrochloric Acid SCHEMBL7553048 0.90 SCN5A (0.42) SCN5AKCNH2HPGDHSD17B10LMNA
SCHEMBL7499390 0.89 SCN5A (0.45) SCN5AKCNH2LMNAALDH1A1POLB

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-7229996-B2 Rifamycin derivatives CUMBRE PHARMACEUTICALS INC. (US) 2007-06-12 US disclosed