SCHEMBL5672248

SCHEMBL5672248

C/C=C/c1ccccc1C(F)(F)F

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NFKB1 P19838 1/20 0.58
MAOB P27338 7/20 0.49
P4HB P07237 1/20 0.47
ABCG2 Q9UNQ0 1/20 0.47
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
LMNA P02545 1/20 0.46
MAPT P10636 1/20 0.46
GRIN2D O15399 2/20 0.44
GRIN3B O60391 2/20 0.44
GRIN1 Q05586 2/20 0.44
GRIN2A Q12879 2/20 0.44
GRIN2B Q13224 2/20 0.44
GRIN2C Q14957 2/20 0.44
GRIN3A Q8TCU5 2/20 0.44
MAOA P21397 1/20 0.44
BACE1 P56817 1/20 0.44
TNF P01375 2/20 0.43
IL6 P05231 1/20 0.43
RAB9A P51151 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
SCHEMBL28924635 1.00 NFKB1 (0.58) NFKB1MAOBP4HBABCG2MEN1
SCHEMBL323188 0.84 NFKB1 (0.53) NFKB1MAOBP4HBABCG2MEN1
SCHEMBL16358097 0.83 NFKB1 (0.42) NFKB1MAOBP4HBABCG2MEN1
SCHEMBL8230502 0.82 NFKB1 (0.41) NFKB1MAOBP4HBABCG2MEN1
SCHEMBL28740456 0.82 NFKB1 (0.41) NFKB1MAOBP4HBABCG2MEN1
SCHEMBL7141617 0.80 NFKB1 (0.60) NFKB1MAOBP4HBABCG2MEN1
SCHEMBL7141613 0.80 NFKB1 (0.60) NFKB1MAOBP4HBABCG2MEN1
SCHEMBL10382469 0.80 ALDH1A1 (0.43) NFKB1MAOBP4HBABCG2MEN1
SCHEMBL31348027 0.80 ALDH1A1 (0.43) NFKB1MAOBP4HBABCG2MEN1
SCHEMBL1044013 0.78 NFKB1 (0.58) NFKB1MAOBP4HBABCG2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1646371-A2 ANTIVIRAL COMPOUNDS AND METHODS Biotron Limited (AU) 2006-04-19 EP claimed
WO-2004112687-A2 ANTIVIRAL ACYLGUANIDINE COMPOUNDS AND METHODS BIOTRON LIMITED (AU) 2004-12-29 WO claimed
EP-3247712-B1 PESTICIDALLY ACTIVE POLYCYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS SYNGENTA PARTICIPATIONS AG (CH) 2022-04-20 EP disclosed
US-20210332039-A1 PESTICIDALLY ACTIVE POLYCYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS SYNGENTA PARTICIPATIONS AG (CH) 2021-10-28 US disclosed
EP-3353173-B1 PESTICIDALLY ACTIVE POLYCYCLIC DERIVATIVES WITH 5-MEMBERED SULFUR CONTAINING HETEROCYCLIC RING SYSTEMS SYNGENTA PARTICIPATIONS AG (CH) 2021-07-21 EP disclosed
US-10981907-B2 Pesticidally active polycyclic derivatives with sulfur containing substituents SYNGENTA PARTICIPATIONS AG (CH) 2021-04-20 US disclosed
EP-3317276-B1 PESTICIDALLY ACTIVE POLYCYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS SYNGENTA PARTICIPATIONS AG (CH) 2020-12-16 EP disclosed
US-10745396-B2 Pesticidally active polycyclic derivatives with sulfur containing substituents SYNGENTA PARTICIPATIONS AG (CH) 2020-08-18 US disclosed
US-10736320-B2 Pesticidally active polycyclic derivatives with 5-membered sulfur containing heterocyclic ring systems SYNGENTA PARTICIPATIONS AG (CH) 2020-08-11 US disclosed
EP-3656770-A2 PESTICIDALLY ACTIVE POLYCYCLIC DERIVATIVES WITH SULFUR SUBSTITUTED FIVE-MEMBERED RING HETEROCYCLES Syngenta Participations AG (CH) 2020-05-27 EP disclosed
EP-3286186-B1 PESTICIDALLY ACTIVE POLYCYCLIC DERIVATIVES WITH SULFUR SUBSTITUTED FIVE MEMBERED RING HETEROCYLES SYNGENTA PARTICIPATIONS AG (CH) 2020-05-06 EP disclosed
US-7524991-B2 Organic electroluminescent devices, aminostyrylnaphthalene compounds and synthesis intermediates thereof, and production processes of the same SONY CORPORATION (JP) 2009-04-28 US disclosed
US-7524991-B2 Organic electroluminescent devices, aminostyrylnaphthalene compounds and synthesis intermediates thereof, and production processes of the same SONY CORPORATION (JP) 2009-04-28 US disclosed
US-7402344-B2 Organic electroluminescent devices and aminostyrylnaphthalene compounds SONY CORPORATION (JP) 2008-07-22 US disclosed
US-7402344-B2 Organic electroluminescent devices and aminostyrylnaphthalene compounds SONY CORPORATION (JP) 2008-07-22 US disclosed
US-20080146586-A1 DICARBONYL DERIVATIVES AND METHODS OF USE ABRAXIS BIOSCIENCE (US) 2008-06-19 US disclosed
US-20080146586-A1 DICARBONYL DERIVATIVES AND METHODS OF USE ABRAXIS BIOSCIENCE (US) 2008-06-19 US disclosed
US-20080051607-A1 ORGANIC ELECTROLUMINESCENT DEVICES, AMINOSTYRLNAPHTHALENE COMPOUNDS AND SYNTHESIS INTERMEDIATES THEREOF, AND PRODUCTION PROCESSES OF THE SAME SONY CORPORATION (JP) 2008-02-28 US disclosed
US-20080051607-A1 ORGANIC ELECTROLUMINESCENT DEVICES, AMINOSTYRLNAPHTHALENE COMPOUNDS AND SYNTHESIS INTERMEDIATES THEREOF, AND PRODUCTION PROCESSES OF THE SAME SONY CORPORATION (JP) 2008-02-28 US disclosed
US-7205324-B2 Inhibitors of IMPDH enzyme BRISTOL-MYERS SQUIBB COMPANY (US) 2007-04-17 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 (6 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-20080146586-A1 DICARBONYL DERIVATIVES AND METHODS OF USE AADAC, DCK, MLYCD NFKB1 1269/4885MAOB 2670/4885P4HB 1352/4885
US-20080051607-A1 ORGANIC ELECTROLUMINESCENT DEVICES, AMINOSTYRLNAPHTHALENE COMPOUNDS AND SYNTHESIS INTERMEDIATES THEREOF, AND PRODUCTION PROCESSES OF THE SAME ASNS, RPS24, L1CAM NFKB1 3321/4885MAOB 799/4885P4HB 3302/4885
US-10981907-B2 Pesticidally active polycyclic derivatives with sulfur containing substituents DDT, ACHE, GSTM1 NFKB1 1850/4885MAOB 738/4885P4HB 664/4885
US-10745396-B2 Pesticidally active polycyclic derivatives with sulfur containing substituents DDT, SQOR, ACHE NFKB1 2328/4885MAOB 527/4885P4HB 517/4885
US-20210332039-A1 PESTICIDALLY ACTIVE POLYCYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS DDT, ACHE, SQOR NFKB1 1697/4885MAOB 841/4885P4HB 644/4885
US-10736320-B2 Pesticidally active polycyclic derivatives with 5-membered sulfur containing heterocyclic ring systems DDT, TST, GSS NFKB1 1027/4885MAOB 1072/4885P4HB 709/4885

“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.