SCHEMBL20554841

SCHEMBL20554841

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

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TEAD1 P28347 6/20 0.47
BTK Q06187 1/20 0.41
P2RX7 Q99572 2/20 0.38
PTGDR2 Q9Y5Y4 7/20 0.37
TGM2 P21980 1/20 0.36
SLC6A4 P31645 1/20 0.34
HRH3 Q9Y5N1 1/20 0.34

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
SCHEMBL20554707 0.90 TEAD1 (0.47) TEAD1BTKP2RX7PTGDR2TGM2
SCHEMBL20554128 0.90 BTK (0.39) TEAD1BTKP2RX7PTGDR2TGM2
SCHEMBL30132663 0.89 TEAD1 (0.47) TEAD1BTKP2RX7PTGDR2TGM2
SCHEMBL19054502 0.89 TEAD1 (0.47) TEAD1BTKP2RX7PTGDR2TGM2
SCHEMBL20554479 0.88 PTGDR2 (0.36) TEAD1BTKPTGDR2
SCHEMBL30132537 0.88 PTGDR2 (0.36) TEAD1BTKPTGDR2
SCHEMBL20554305 0.88 TEAD1 (0.45) TEAD1BTKP2RX7PTGDR2SLC6A4
SCHEMBL20608867 0.86 TRPV1 (0.36) TEAD1BTKP2RX7
SCHEMBL20554343 0.81 TEAD1 (0.49) TEAD1BTKP2RX7PTGDR2
SCHEMBL30132578 0.81 TEAD1 (0.49) TEAD1BTKP2RX7PTGDR2

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 TEAD1 1478/4885BTK 2944/4885P2RX7 730/4885
US-11447471-B2 α,β-unsaturated amide compound NR1H2, RXRA, RXRB TEAD1 1286/4885BTK 2864/4885P2RX7 605/4885
US-10787428-B2 α,β-unsaturated amide compound NR1H2, NCOA1, NR0B1 TEAD1 1454/4885BTK 2983/4885P2RX7 388/4885
US-20210380551-A1 ALPHA,BETA-UNSATURATED AMIDE COMPOUND NR1H2, NR1H3, NCOA1 TEAD1 1633/4885BTK 3118/4885P2RX7 480/4885
US-11332455-B2 α,β-unsaturated amide compound NR1H2, NCOA1, NR0B1 TEAD1 1454/4885BTK 2983/4885P2RX7 388/4885
US-20190010136-A1 ALPHA,BETA-UNSATURATED AMIDE COMPOUND NR1H2, NR1H3, NCOA1 TEAD1 1633/4885BTK 3118/4885P2RX7 480/4885

“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.