SCHEMBL9664130

SCHEMBL9664130

CSC1CCN(c2c(F)cc3c(=O)c(C(=O)O)c[nH]c3c2C2CC2)C1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.39
ALDH1A1 P00352 4/20 0.39
KDM4E B2RXH2 3/20 0.39
HPGD P15428 3/20 0.39
HSD17B10 Q99714 3/20 0.39
POLB P06746 2/20 0.39
OPRM1 P35372 2/20 0.39
CHRM2 P08172 1/20 0.39
CHRM1 P11229 1/20 0.39
OPRD1 P41143 1/20 0.39
KCNH2 Q12809 4/20 0.39
PMP22 Q01453 1/20 0.38
PRKD3 O94806 1/20 0.38
ALOX15 P16050 1/20 0.38
CLK2 P49760 1/20 0.38
CLK4 Q9HAZ1 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
RPS6KB1 P23443 1/20 0.35
MATK P42679 1/20 0.35
DYRK1A Q13627 1/20 0.35

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
SCHEMBL9665125 0.86 KCNH2 (0.43) LMNAALDH1A1KDM4EHPGDHSD17B10
SCHEMBL8898775 0.83 KDM4E (0.50) LMNAALDH1A1KDM4EHPGDHSD17B10
SCHEMBL10480544 0.83 LMNA (0.41) LMNAALDH1A1KDM4EHPGDHSD17B10
SCHEMBL10859996 0.83 KCNH2 (0.53) ALDH1A1KDM4EHPGDHSD17B10POLB
SCHEMBL9666160 0.82 KDM4E (0.39) LMNAALDH1A1KDM4EHPGDHSD17B10
SCHEMBL9522706 0.82 KDM4E (0.39) LMNAALDH1A1KDM4EHPGDHSD17B10
SCHEMBL10480601 0.82 ALDH1A1 (0.44) ALDH1A1KDM4EPOLBOPRM1CHRM2
SCHEMBL3239412 0.82 KDM4E (0.48) LMNAALDH1A1KDM4EHPGDHSD17B10
Hydrochloric Acid SCHEMBL7253434 0.81 KDM4E (0.46) LMNAALDH1A1KDM4EHPGDHSD17B10
SCHEMBL9209238 0.80 ALDH1A1 (0.41) LMNAALDH1A1KDM4EHPGDHSD17B10

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
EP-0511347-A1 META-SUBSTITUTED PHENYL ALANINE DERIVATIVES Pentapharm A.G. (CH) 1992-11-04 EP disclosed
EP-0500835-A1 A NOVEL QUINOLONE CARBOXYLIC ACID DERIVATIVE. DAE WOONG PHARMA (KR) 1992-09-02 EP disclosed
WO-1992004342-A1 A NOVEL QUINOLONE CARBOXYLIC ACID DERIVATIVE DAEWOONG PHARMACEUTICAL CO., LTD. (KR) 1992-03-19 WO disclosed