SCHEMBL8979022

SCHEMBL8979022

COC(=O)c1cc(F)c(O)c(F)c1F

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.47
LMNA P02545 2/20 0.47
GAA P10253 2/20 0.47
POLB P06746 1/20 0.47
NFKB1 P19838 1/20 0.47
XDH P47989 1/20 0.47
GFER P55789 1/20 0.47
NFKB2 Q00653 1/20 0.47
RELA Q04206 1/20 0.47
FUT7 Q11130 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
CA12 O43570 3/20 0.43
CA1 P00915 3/20 0.43
CA2 P00918 3/20 0.43
CA7 P43166 3/20 0.43
CA9 Q16790 3/20 0.43
CA14 Q9ULX7 3/20 0.43
PDK2 Q15119 1/20 0.43
PDK4 Q16654 1/20 0.43

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
SCHEMBL24445911 0.86 KDM4E (0.48) KDM4ELMNAGAAPOLBNFKB1
SCHEMBL1994444 0.86 MAPT (0.43) KDM4ELMNAGAAPOLBNFKB1
SCHEMBL24379389 0.85 GAA (0.44) KDM4ELMNAGAAPOLBNFKB1
SCHEMBL6644948 0.85 KDM4E (0.47) KDM4ELMNAGAAPOLBNFKB1
SCHEMBL29612064 0.84 KDM4E (0.46) KDM4ELMNAGAAPOLBNFKB1
SCHEMBL24325154 0.84 KDM4E (0.46) KDM4ELMNAGAAPOLBNFKB1
SCHEMBL30792054 0.81 KDM4E (0.47) KDM4ELMNAGAAPOLBNFKB1
SCHEMBL5215048 0.81 KDM4E (0.47) KDM4ELMNAGAAPOLBNFKB1
SCHEMBL31177764 0.81 ERN1 (0.49) KDM4ELMNAGAAPOLBNFKB1
SCHEMBL18149338 0.81 KDM4E (0.46) KDM4EGAAPOLBCA12CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4001336-A1 POLYURETHANE, POLYURETHANE PRODUCTION METHOD, CONDUCTIVE PASTE COMPOSITION, CONDUCTIVE WIRE, AND METHOD FOR PRODUCING CONDUCTIVE WIRE Shin-Etsu Chemical Co., Ltd. (JP) 2022-05-25 EP disclosed
US-5525258-A LOW VISCOSITY, SHORT RESPONSE TIME HOECHST AKTIENGESELLSCHAFT (DE) 1996-06-11 US disclosed