SCHEMBL10107044

SCHEMBL10107044

COCOc1cc(C(F)(F)F)ccc1F

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.42
KDM4E B2RXH2 4/20 0.40
HPGD P15428 3/20 0.40
HTT P42858 2/20 0.39
KMT2A Q03164 1/20 0.39
PDE2A O00408 2/20 0.38
EGFR P00533 1/20 0.38
ALOX5AP P20292 2/20 0.38
FEN1 P39748 2/20 0.38
HTR2A P28223 1/20 0.38
SLC6A4 P31645 1/20 0.38
KCNH2 Q12809 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
ATM Q13315 1/20 0.37
ALDH1A1 P00352 3/20 0.36
HSD17B10 Q99714 2/20 0.36
MRGPRX4 Q96LA9 1/20 0.36
CYP2C19 P33261 2/20 0.36

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
SCHEMBL12244251 0.83 L3MBTL1 (0.44) IDO1KDM4EHPGDHTTPDE2A
SCHEMBL12126027 0.82 CYP1A2 (0.51) IDO1HPGDHTTPDE2AL3MBTL1
SCHEMBL1138862 0.81 L3MBTL1 (0.46) KDM4EHPGDHTTKMT2AEGFR
SCHEMBL31026298 0.81 KDM4E (0.41) KDM4EHPGDHTTKMT2AEGFR
SCHEMBL29276098 0.81 KDM4E (0.38) KDM4EHPGDHTTKMT2AEGFR
Water SCHEMBL27635873 0.81 KDM4E (0.38) KDM4EHPGDHTTKMT2AEGFR
Water SCHEMBL27635872 0.80 KDM4E (0.37) KDM4EHPGDHTTKMT2AEGFR
SCHEMBL935540 0.80 L3MBTL1 (0.45) IDO1KDM4EHPGDKMT2APDE2A
SCHEMBL384449 0.79 L3MBTL1 (0.43) IDO1KDM4EHPGDHTTKMT2A
SCHEMBL30994957 0.79 KDM4E (0.39) KDM4EHPGDHTTKMT2AEGFR

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 54 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105492075-B Inhibitors of viral replication, their preparation method and their therapeutical uses HIVIH公司 2019-11-12 CN disclosed
EP-2697213-B1 INHIBITORS OF VIRAL REPLICATION, THEIR PROCESS OF PREPARATION AND THEIR THERAPEUTICAL USES HIVIH (FR) 2018-12-12 EP disclosed
EP-3016714-B1 INHIBITORS OF VIRAL REPLICATION, THEIR PROCESS OF PREPARATION AND THEIR THERAPEUTICAL USES HIVIH (FR) 2018-09-19 EP disclosed
US-9994509-B2 Inhibitors of viral replication, their process of preparation and their therapeutical uses HIVIH (FR) 2018-06-12 US disclosed
US-9994509-B2 Inhibitors of viral replication, their process of preparation and their therapeutical uses HIVIH (FR) 2018-06-12 US disclosed
US-9994509-B2 Inhibitors of viral replication, their process of preparation and their therapeutical uses HIVIH (FR) 2018-06-12 US disclosed
EP-2906539-B1 INHIBITORS OF VIRAL REPLICATION, THEIR PROCESS OF PREPARATION AND THEIR THERAPEUTICAL USES HIVIH (FR) 2017-06-21 EP disclosed
US-9604900-B2 Inhibitors of viral replication, their process of preparation and their therapeutical uses LABORATOIRE BIODIM (FR) 2017-03-28 US disclosed
US-9604900-B2 Inhibitors of viral replication, their process of preparation and their therapeutical uses LABORATOIRE BIODIM (FR) 2017-03-28 US disclosed
US-9604900-B2 Inhibitors of viral replication, their process of preparation and their therapeutical uses LABORATOIRE BIODIM (FR) 2017-03-28 US disclosed
US-20090318694-A1 Cross-Linked Amine Compounds and Agents for Pest Control NIPPON SODA CO., LTD. (JP) 2009-12-24 US disclosed
US-20090143443-A1 CYCLIC AMINE COMPOUND AND PEST CONTROL AGENT NIPPON SODA CO., LTD. (JP) 2009-06-04 US disclosed
US-20090143443-A1 CYCLIC AMINE COMPOUND AND PEST CONTROL AGENT NIPPON SODA CO., LTD. (JP) 2009-06-04 US disclosed
US-7485727-B2 Cyclic amine compound and pest control agent NIPPON SODA CO., LTD. (JP) 2009-02-03 US disclosed
US-7485727-B2 Cyclic amine compound and pest control agent NIPPON SODA CO., LTD. (JP) 2009-02-03 US disclosed
US-20080319003-A1 CYCLIC AMINE COMPOUND AND PEST CONTROL AGENT NIPPON SODA CO., LTD. (JP) 2008-12-25 US disclosed
US-20080319003-A1 CYCLIC AMINE COMPOUND AND PEST CONTROL AGENT NIPPON SODA CO., LTD. (JP) 2008-12-25 US disclosed
EP-1932844-A1 BRIDGED CYCLIC AMINE COMPOUND AND PEST CONTROL AGENT NIPPON SODA CO., LTD. (JP) 2008-06-18 EP disclosed
US-20080045569-A1 Cyclic Amine Compound and Pest Control Agent NIPPON SODA CO., LTD. (JP) 2008-02-21 US disclosed
US-20080045569-A1 Cyclic Amine Compound and Pest Control Agent NIPPON SODA CO., LTD. (JP) 2008-02-21 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080045569-A1 Cyclic Amine Compound and Pest Control Agent H1-0, H1-2, H1-4 IDO1 228/4885KDM4E 373/4885HPGD 3647/4885
US-20090143443-A1 CYCLIC AMINE COMPOUND AND PEST CONTROL AGENT TAAR1, CBR3, CBR1 IDO1 338/4885KDM4E 1169/4885HPGD 3821/4885
US-20080319003-A1 CYCLIC AMINE COMPOUND AND PEST CONTROL AGENT H1-0, H1-2, H1-4 IDO1 276/4885KDM4E 339/4885HPGD 3749/4885
US-20090318694-A1 Cross-Linked Amine Compounds and Agents for Pest Control CYCS, NPY1R, CYBB IDO1 43/4885KDM4E 1474/4885HPGD 2540/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.