SCHEMBL1333665

SCHEMBL1333665

C=C(F)Cc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES1 P23141 2/20 0.52
CES2 O00748 1/20 0.52
AKR1B1 P15121 1/20 0.52
TSHR P16473 1/20 0.46
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.44
HDAC8 Q9BY41 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
FNTA P49354 1/20 0.43
FNTB P49356 1/20 0.43
CALM1 P0DP23 1/20 0.43
TDP1 Q9NUW8 1/20 0.42
ALDH1A1 P00352 2/20 0.41
MAPK1 P28482 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CTBP2 P56545 1/20 0.41
EPHX2 P34913 1/20 0.41
LMNA P02545 1/20 0.41
GAA P10253 1/20 0.41
HTT P42858 1/20 0.41

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
SCHEMBL822099 0.80 CES1 (0.55) CES1CES2AKR1B1TSHRKMT2A
SCHEMBL575074 0.80 AKR1B1 (0.62) CES1CES2AKR1B1TSHRKMT2A
SCHEMBL2241627 0.80 CES1 (0.55) CES1CES2AKR1B1TSHRKMT2A
SCHEMBL12095508 0.80 CES1 (0.55) CES1CES2AKR1B1TSHRKMT2A
SCHEMBL162822 0.79 CES1 (0.54) CES1CES2AKR1B1TSHRKMT2A
Ammonia Solution, Strong SCHEMBL27465072 0.78 CES1 (0.52) CES1CES2AKR1B1TSHRKMT2A
Ammonia Solution, Strong SCHEMBL574785 0.78 CES1 (0.52) CES1CES2AKR1B1TSHRKMT2A
SCHEMBL3855307 0.78 CES1 (0.52) CES1CES2AKR1B1TSHRKMT2A
SCHEMBL6077860 0.78 CES1 (0.52) CES1CES2AKR1B1TSHRKMT2A
SCHEMBL6348874 0.76 CES1 (0.64) CES1CES2AKR1B1TSHRKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230019712-A1 ORGANIC ELECTROLUMINESCENCE DEVICE AND ELECTRONIC APPARATUS PROVIDED WITH THE SAME IDEMITSU KOSAN CO.,LTD. (JP) 2023-01-19 US disclosed
US-20230020436-A1 NOVEL COMPOUND, ORGANIC ELECTROLUMINESCENCE DEVICE, AND ELECTRONIC APPARATUS IDEMITSU KOSAN CO.,LTD. (JP) 2023-01-19 US disclosed
US-20230011996-A1 ORGANIC ELECTROLUMINESCENCE DEVICE AND ELECTRONIC APPARATUS PROVIDED WITH THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2023-01-12 US disclosed
US-20210395233-A1 NEW COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE IDEMITSU KOSAN CO.,LTD. (JP) 2021-12-23 US disclosed
US-20200388768-A1 ORGANIC ELECTROLUMINESCENCE DEVICE AND ELECTRONIC APPARATUS IDEMITSU KOSAN CO.,LTD. (JP) 2020-12-10 US disclosed
US-20200388767-A1 ORGANIC ELECTROLUMINESCENCE DEVICE AND ELECTRONIC APPARATUS IDEMITSU KOSAN CO.,LTD. (JP) 2020-12-10 US disclosed
US-10811612-B2 Organic electroluminescence device and electronic apparatus provided with the same IDEMITSU KOSAN CO., LTD. (JP) 2020-10-20 US disclosed
US-10804474-B2 Organic electroluminescence device and electronic apparatus provided with the same IDEMITSU KOSAN CO., LTD. (JP) 2020-10-13 US disclosed
US-10777752-B2 Organic electroluminescence device and electronic apparatus provided with the same IDEMITSU KOSAN CO., LTD. (JP) 2020-09-15 US disclosed
US-10763441-B2 Organic electroluminescence device and electronic apparatus provided with the same IDEMITSU KOSAN CO., LTD. (JP) 2020-09-01 US disclosed
US-10593889-B1 Compound and organic electroluminescence device IDEMITSU KOSAN CO., LTD. (JP) 2020-03-17 US disclosed
EP-3605635-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT AND ELECTRONIC DEVICE Idemitsu Kosan Co., Ltd. (JP) 2020-02-05 EP disclosed
CN-101945905-B Resin composition ASAHI KASEI E MATERIALS CORP 2013-06-26 CN disclosed
US-20110282063-A1 METHOD OF PRODUCING A DIAZAFLUORENE COMPOUND CANON KABUSHIKI KAISHA (JP) 2011-11-17 US disclosed
US-20080161574-A1 DIAZAFLUORENE COMPOUND CANON KABUSHIKI KAISHA (JP) 2008-07-03 US disclosed
EP-0410379-B1 Pharmaceutically active 3-aryl and 3-heteroaryl-2-fluoro-1-olefins MERRELL DOW PHARMA (US) 1996-01-31 EP disclosed
US-5068465-A Hypotensive agents or enzyme inhibitors for treatment of hypertension MERRELL DOW PHARMACEUTICALS INC. (US) 1991-11-26 US disclosed
EP-0410379-A2 Pharmaceutically active 3-aryl and 3-heteroaryl-2-fluoro-1-olefins MERRELL DOW PHARMACEUTICALS INC. (US) 1991-01-30 EP disclosed
EP-0410380-A2 Novel process for the synthesis of 2-fluoro-1-olefins MERRELL DOW PHARMACEUTICALS INC. (US) 1991-01-30 EP disclosed
US-4981868-A ENZYME INHIBITORS, HYPOTENSIVES MERRELL DOW PHARMACEUTICAL (US) 1991-01-01 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 (8 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-20080161574-A1 DIAZAFLUORENE COMPOUND AFF1, NPFFR1, AFF2 CES1 1698/4885CES2 1918/4885AKR1B1 1622/4885
US-20230011996-A1 ORGANIC ELECTROLUMINESCENCE DEVICE AND ELECTRONIC APPARATUS PROVIDED WITH THE SAME RER1, RPS19, ESR1 CES1 2657/4885CES2 1344/4885AKR1B1 2379/4885
US-20210395233-A1 NEW COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE AHR, UQCRB, AOC2 CES1 3299/4885CES2 1639/4885AKR1B1 687/4885
US-10593889-B1 Compound and organic electroluminescence device LEF1, NOM1, RIF1 CES1 3038/4885CES2 1883/4885AKR1B1 2614/4885
US-10811612-B2 Organic electroluminescence device and electronic apparatus provided with the same RER1, RPS19, ESR1 CES1 2316/4885CES2 1117/4885AKR1B1 2408/4885
US-10777752-B2 Organic electroluminescence device and electronic apparatus provided with the same RER1, RPS19, MRPS22 CES1 3967/4885CES2 1418/4885AKR1B1 2261/4885
US-20110282063-A1 METHOD OF PRODUCING A DIAZAFLUORENE COMPOUND AFF1, AFF2, AFF4 CES1 1318/4885CES2 1011/4885AKR1B1 1380/4885
US-20230020436-A1 NOVEL COMPOUND, ORGANIC ELECTROLUMINESCENCE DEVICE, AND ELECTRONIC APPARATUS MRPS22, RER1, EMC2 CES1 4593/4885CES2 2368/4885AKR1B1 3994/4885

“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.