SCHEMBL22831781

SCHEMBL22831781

CC(C)CS(=O)(=O)Nc1ccc(F)c(I)c1Cl

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
BRAF P15056 10/20 0.47
MAPT P10636 1/20 0.44
CYP2C9 P11712 3/20 0.39
CYP3A4 P08684 2/20 0.39
ALOX5AP P20292 2/20 0.37
FEN1 P39748 2/20 0.37
PTGES2 Q9H7Z7 1/20 0.37
PSIP1 O75475 1/20 0.36
CYP2C19 P33261 1/20 0.36
BRD4 O60885 1/20 0.35

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
SCHEMBL29561839 1.00 BRAF (0.47) BRAFMAPTCYP2C9CYP3A4ALOX5AP
SCHEMBL29561633 0.85 PSIP1 (0.51) BRAFCYP2C9CYP3A4PSIP1CYP2C19
SCHEMBL22831839 0.85 PSIP1 (0.51) BRAFCYP2C9CYP3A4PSIP1CYP2C19
SCHEMBL9930938 0.83 BRAF (0.47) BRAFMAPTCYP2C9CYP3A4ALOX5AP
SCHEMBL16253620 0.81 CYP3A4 (0.56) BRAFCYP2C9CYP3A4CYP2C19
SCHEMBL29561940 0.81 CYP3A4 (0.56) BRAFCYP2C9CYP3A4CYP2C19
SCHEMBL1462056 0.80 BRAF (0.49) BRAFMAPTCYP2C9CYP3A4ALOX5AP
SCHEMBL22831897 0.79 BRAF (0.48) BRAFCYP2C9CYP3A4PTGES2PSIP1
SCHEMBL29561987 0.79 BRAF (0.48) BRAFCYP2C9CYP3A4PTGES2PSIP1
SCHEMBL9931434 0.79 BRAF (0.49) BRAFMAPTCYP2C9CYP3A4ALOX5AP

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 1/4885MAPT 654/4885CYP2C9 1687/4885
US-11634409-B2 Compounds for the treatment of BRAF-associated diseases and disorders BRAF, NRAS, RAF1 BRAF 1/4885MAPT 654/4885CYP2C9 1687/4885
US-11414404-B2 Compounds for the treatment of BRAF-associated diseases and disorders BRAF, NRAS, RAF1 BRAF 1/4885MAPT 654/4885CYP2C9 1687/4885
US-20220289721-A1 COMPOUNDS FOR THE TREATMENT OF BRAF-ASSOCIATED DISEASES AND DISORDERS BRAF, NRAS, RAF1 BRAF 1/4885MAPT 654/4885CYP2C9 1687/4885

“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.