SCHEMBL21783471

SCHEMBL21783471

CC(C)(C)OC(=O)Nc1cc(F)c(Cl)nc1C1CC1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
BRAF P15056 1/20 0.41
BRD4 O60885 1/20 0.38
BRD2 P25440 1/20 0.38
BRD3 Q15059 1/20 0.38
CREBBP Q92793 1/20 0.38
CYP17A1 P05093 1/20 0.38
DGAT1 O75907 2/20 0.38
ATR Q13535 1/20 0.37
USP30 Q70CQ3 1/20 0.36
AAK1 Q2M2I8 2/20 0.35
P2RX3 P56373 2/20 0.35
ACACB O00763 1/20 0.34
ACACA Q13085 1/20 0.34
MAPKAPK2 P49137 1/20 0.34
LCK P06239 1/20 0.34
SYK P43405 1/20 0.34
BDKRB1 P46663 1/20 0.34
RXFP1 Q9HBX9 1/20 0.33
RORC P51449 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
SCHEMBL30045766 1.00 BRAF (0.41) BRAFBRD4BRD2BRD3CREBBP
SCHEMBL21783561 0.85 BRAF (0.40) BRAFBRD4BRD2BRD3CREBBP
SCHEMBL21783559 0.84 BRAF (0.39) BRAFBRD4BRD2BRD3CREBBP
SCHEMBL30045577 0.84 BRAF (0.39) BRAFBRD4BRD2BRD3CREBBP
SCHEMBL16069701 0.83 CYP17A1 (0.43) BRAFCYP17A1ATRAAK1P2RX3
SCHEMBL31018064 0.83 CYP17A1 (0.43) BRAFCYP17A1ATRAAK1P2RX3
SCHEMBL23148155 0.81 CYP17A1 (0.41) BRAFCYP17A1ATRAAK1P2RX3
SCHEMBL21777273 0.80 KEAP1 (0.41)
SCHEMBL25027545 0.80 BRD4 (0.40) BRD4BRD2BRD3CREBBPDGAT1
SCHEMBL29361617 0.80 BRD4 (0.40) BRD4BRD2BRD3CREBBPDGAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112638879-B Heteroaryl substituted sulfonamide compounds and their use as therapeutic agents 泽农医药公司 2024-06-18 CN disclosed
US-11639351-B2 Heteroaryl-substituted sulfonamide compounds and their use as therapeutic agents XENON PHARMACEUTICALS INC. 2023-05-02 US disclosed
US-11639351-B2 Heteroaryl-substituted sulfonamide compounds and their use as therapeutic agents XENON PHARMACEUTICALS INC. 2023-05-02 US disclosed
US-10981905-B2 Heteroaryl-substituted sulfonamide compounds and their use as therapeutic agents XENON PHARMACEUTICALS INC. (CA) 2021-04-20 US disclosed
US-20200157089-A1 HETEROARYL-SUBSTITUTED SULFONAMIDE COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC. (CA) 2020-05-21 US disclosed
WO-2020047323-A1 HETEROARYL-SUBSTITUTED SULFONAMIDE COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC. (CA) 2020-03-05 WO disclosed
US-20160220564-A1 SUBSTITUTUED QUINOXALINES AS FGFR KINASE INHIBITORS ASTEX THERAPEUTICS LIMITED (GB) 2016-08-04 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-11639351-B2 Heteroaryl-substituted sulfonamide compounds and their use as therapeutic agents SCN1A, SCN2A, SCN2B BRAF 414/4885BRD4 893/4885BRD2 1348/4885
US-20200157089-A1 HETEROARYL-SUBSTITUTED SULFONAMIDE COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS SCN1A, SCN2A, SCN2B BRAF 414/4885BRD4 893/4885BRD2 1348/4885
US-20160220564-A1 SUBSTITUTUED QUINOXALINES AS FGFR KINASE INHIBITORS FGFR1, FGFR3, FGFR4 BRAF 24/4885BRD4 142/4885BRD2 864/4885
US-10981905-B2 Heteroaryl-substituted sulfonamide compounds and their use as therapeutic agents SCN1A, SCN2A, SCN2B BRAF 414/4885BRD4 893/4885BRD2 1348/4885

“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.