SCHEMBL22832016

SCHEMBL22832016

O=S(=O)(CC1CC1)Nc1ccc(F)c(I)c1Cl

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRAF P15056 12/20 0.47
ACLY P53396 2/20 0.35
JAK1 P23458 2/20 0.33
JAK2 O60674 1/20 0.33
TYK2 P29597 1/20 0.33
JAK3 P52333 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
PSIP1 O75475 1/20 0.33
RAF1 P04049 1/20 0.32
PDGFRB P09619 1/20 0.32
CSNK2A2 P19784 1/20 0.32
MAP2K2 P36507 1/20 0.32
CSNK2B P67870 1/20 0.32
CSNK2A1 P68400 1/20 0.32
MAP2K1 Q02750 1/20 0.32
CSNK2A3 Q8NEV1 1/20 0.32
AURKC Q9UQB9 1/20 0.32
CAMK2A Q9UQM7 1/20 0.32

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
SCHEMBL29561756 1.00 BRAF (0.47) BRAFACLYJAK1JAK2TYK2
SCHEMBL1460854 0.83 BRAF (0.47) BRAFACLYJAK1JAK2TYK2
SCHEMBL22831839 0.81 PSIP1 (0.51) BRAFCYP3A4CYP2C9CYP2C19PSIP1
SCHEMBL29561633 0.81 PSIP1 (0.51) BRAFCYP3A4CYP2C9CYP2C19PSIP1
SCHEMBL1462061 0.80 BRAF (0.46) BRAFACLYJAK1
SCHEMBL9930756 0.79 BRAF (0.46) BRAFACLYJAK1JAK2TYK2
SCHEMBL29561940 0.77 CYP3A4 (0.56) BRAFCYP3A4CYP2C9CYP2C19
SCHEMBL16253620 0.77 CYP3A4 (0.56) BRAFCYP3A4CYP2C9CYP2C19
SCHEMBL22831781 0.76 BRAF (0.47) BRAFCYP3A4CYP2C9CYP2C19PSIP1
SCHEMBL22831933 0.76 BRAF (0.46) BRAFCYP3A4CYP2C9CYP2C19RAF1

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
US-11634409-B2 Compounds for the treatment of BRAF-associated diseases and disorders ARRAY BIOPHARMA INC. (US) 2023-04-25 US disclosed
US-20220289721-A1 COMPOUNDS FOR THE TREATMENT OF BRAF-ASSOCIATED DISEASES AND DISORDERS ARRAY BIOPHARMA INC. (US) 2022-09-15 US disclosed
US-11414404-B2 Compounds for the treatment of BRAF-associated diseases and disorders ARRAY BIOPHARMA INC. (US) 2022-08-16 US disclosed
EP-3990437-A1 QUINAZOLIN-4-ONE DERIVATIVES USEFUL FOR THE TREATMENT OF BRAF-ASSOCIATED DISEASES AND DISORDERS Array Biopharma, Inc. (US) 2022-05-04 EP disclosed
CN-114026073-A Quinazolin-4-one derivatives for the treatment of BRAF related diseases and disorders ARRAY生物制药公司 2022-02-08 CN disclosed
US-20200407344-A1 COMPOUNDS FOR THE TREATMENT OF BRAF-ASSOCIATED DISEASES AND DISORDERS ARRAY BIOPHARMA INC. (US) 2020-12-31 US disclosed
WO-2020261156-A1 QUINAZOLIN-4-ONE DERIVATIVES USEFUL FOR THE TREATMENT OF BRAF-ASSOCIATED DISEASES AND DISORDERS ARRAY BIOPHARMA INC. (US) 2020-12-30 WO 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-20200407344-A1 COMPOUNDS FOR THE TREATMENT OF BRAF-ASSOCIATED DISEASES AND DISORDERS BRAF, NRAS, RAF1 BRAF 1/4885ACLY 3368/4885JAK1 77/4885
US-11634409-B2 Compounds for the treatment of BRAF-associated diseases and disorders BRAF, NRAS, RAF1 BRAF 1/4885ACLY 3368/4885JAK1 77/4885
US-11414404-B2 Compounds for the treatment of BRAF-associated diseases and disorders BRAF, NRAS, RAF1 BRAF 1/4885ACLY 3368/4885JAK1 77/4885
US-20220289721-A1 COMPOUNDS FOR THE TREATMENT OF BRAF-ASSOCIATED DISEASES AND DISORDERS BRAF, NRAS, RAF1 BRAF 1/4885ACLY 3368/4885JAK1 77/4885

“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.