SCHEMBL10915149

SCHEMBL10915149

CC1CN(c2c(F)cc3c(=O)c(OC(=O)O)cn(-c4ccccc4F)c3c2F)CC(C)N1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 5/20 0.44
▸ KDM4E B2RXH2 5/20 0.44
▸ HSD17B10 Q99714 4/20 0.44
▸ ALDH1A1 P00352 4/20 0.44
▸ PMP22 Q01453 1/20 0.43
▸ TOP2A P11388 9/20 0.40
▸ TOP2B Q02880 9/20 0.40
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ POLB P06746 2/20 0.39
▸ KCNH2 Q12809 2/20 0.39
▸ PRKD3 O94806 1/20 0.39
▸ ALOX15 P16050 1/20 0.39
▸ OPRM1 P35372 1/20 0.39
▸ CLK2 P49760 1/20 0.39
▸ CLK4 Q9HAZ1 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ CACNA1F O60840 1/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ CACNA1D Q01668 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
SCHEMBL9869366 0.89 KDM4E (0.54) HPGDKDM4EHSD17B10ALDH1A1PMP22
SCHEMBL10912098 0.86 KDM4E (0.43) HPGDKDM4EHSD17B10ALDH1A1PMP22
SCHEMBL10911561 0.86 KDM4E (0.44) HPGDKDM4EHSD17B10ALDH1A1PMP22
SCHEMBL9636639 0.82 MEN1 (0.55) HPGDKDM4EHSD17B10ALDH1A1PMP22
SCHEMBL10913865 0.81 KDM4E (0.59) HPGDKDM4EHSD17B10ALDH1A1PMP22
SCHEMBL10374458 0.81 HPGD (0.59) HPGDKDM4EHSD17B10ALDH1A1PMP22
SCHEMBL10913415 0.80 KDM4E (0.56) HPGDKDM4EHSD17B10ALDH1A1PMP22
SCHEMBL9047556 0.80 KDM4E (0.55) HPGDKDM4EHSD17B10ALDH1A1PMP22
SCHEMBL9044502 0.78 LMNA (0.40) HPGDKDM4EHSD17B10ALDH1A1TOP2A
Hydrochloric Acid SCHEMBL9035741 0.77 LMNA (0.45) HPGDKDM4EHSD17B10ALDH1A1PMP22

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
EP-0201829-A1 1-Aryl-4-quinolone-3-carboxylic acids BAYER AG (DE) 1986-11-20 — — EP disclosed
Send feedback