SCHEMBL20554128

SCHEMBL20554128

C=CC(=O)NC1CCOc2c1ccc(Oc1ccc(F)cc1)c2F

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
BTK Q06187 2/20 0.39
BRD4 O60885 3/20 0.35
TRPV1 Q8NER1 2/20 0.34
TEAD1 P28347 1/20 0.34
KDM4C Q9H3R0 1/20 0.34
SLC6A2 P23975 3/20 0.33
SLC6A4 P31645 3/20 0.33
SLC6A3 Q01959 3/20 0.33
PTGDR2 Q9Y5Y4 2/20 0.33
HTR1A P08908 2/20 0.33
TGM2 P21980 1/20 0.33
P2RX7 Q99572 1/20 0.33
RET P07949 1/20 0.33

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
SCHEMBL30132537 0.92 PTGDR2 (0.36) BTKBRD4TEAD1PTGDR2
SCHEMBL20554479 0.92 PTGDR2 (0.36) BTKBRD4TEAD1PTGDR2
SCHEMBL20554841 0.90 TEAD1 (0.47) BTKTEAD1SLC6A4PTGDR2TGM2
SCHEMBL20608867 0.84 TRPV1 (0.36) BTKTRPV1TEAD1KDM4CP2RX7
SCHEMBL19054502 0.81 TEAD1 (0.47) BTKTRPV1TEAD1PTGDR2TGM2
SCHEMBL30132663 0.81 TEAD1 (0.47) BTKTRPV1TEAD1PTGDR2TGM2
SCHEMBL20554707 0.80 TEAD1 (0.47) BTKTRPV1TEAD1SLC6A4PTGDR2
SCHEMBL20554332 0.80 TEAD1 (0.35) TRPV1TEAD1P2RX7
SCHEMBL20554045 0.80 P2RX7 (0.37) BRD4TEAD1PTGDR2P2RX7
SCHEMBL30132494 0.80 P2RX7 (0.37) BRD4TEAD1PTGDR2P2RX7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110770211-B Alpha, beta unsaturated amide compound 协和麒麟株式会社 2023-09-19 CN disclosed
CN-108430972-B Alpha, beta-unsaturated amide compound 协和麒麟株式会社 2022-12-27 CN disclosed
US-11447471-B2 α,β-unsaturated amide compound KYOWA KIRIN CO., LTD. (JP) 2022-09-20 US disclosed
US-11332455-B2 α,β-unsaturated amide compound KYOWA KIRIN CO., LTD. (JP) 2022-05-17 US disclosed
US-20210380551-A1 ALPHA,BETA-UNSATURATED AMIDE COMPOUND KYOWA KIRIN CO., LTD. (JP) 2021-12-09 US disclosed
US-20210155612-A1 Alpha,Beta-UNSATURATED AMIDE COMPOUND KYOWA KIRIN CO., LTD. (JP) 2021-05-27 US disclosed
US-10787428-B2 α,β-unsaturated amide compound KYOWA KIRIN CO., LTD. (JP) 2020-09-29 US disclosed
EP-3712129-A1 ALPHA, BETA-UNSATURATED AMIDE COMPOUND Kyowa Kirin Co., Ltd. (JP) 2020-09-23 EP disclosed
CN-110770211-A α unsaturated amide compound 协和麒麟株式会社 2020-02-07 CN disclosed
US-20190010136-A1 ALPHA,BETA-UNSATURATED AMIDE COMPOUND KYOWA HAKKO KIRIN CO., LTD. (JP) 2019-01-10 US disclosed
EP-3401309-A1 a, ß UNSATURATED AMIDE COMPOUND Kyowa Hakko Kirin Co., Ltd. (JP) 2018-11-14 EP 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-20210155612-A1 Alpha,Beta-UNSATURATED AMIDE COMPOUND NR1H2, NR1H3, RXRA BTK 2944/4885BRD4 859/4885TRPV1 1750/4885
US-11447471-B2 α,β-unsaturated amide compound NR1H2, RXRA, RXRB BTK 2864/4885BRD4 757/4885TRPV1 1595/4885
US-10787428-B2 α,β-unsaturated amide compound NR1H2, NCOA1, NR0B1 BTK 2983/4885BRD4 555/4885TRPV1 1746/4885
US-20210380551-A1 ALPHA,BETA-UNSATURATED AMIDE COMPOUND NR1H2, NR1H3, NCOA1 BTK 3118/4885BRD4 674/4885TRPV1 1868/4885
US-11332455-B2 α,β-unsaturated amide compound NR1H2, NCOA1, NR0B1 BTK 2983/4885BRD4 555/4885TRPV1 1746/4885
US-20190010136-A1 ALPHA,BETA-UNSATURATED AMIDE COMPOUND NR1H2, NR1H3, NCOA1 BTK 3118/4885BRD4 674/4885TRPV1 1868/4885

“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.