SCHEMBL21836258

SCHEMBL21836258

CC(=NC(c1ccccc1)c1ccccc1)c1ncc(C(=O)Nc2cc(C(F)(F)F)c(Cl)cn2)s1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 3/20 0.47
ABL1 P00519 3/20 0.47
BCR P11274 3/20 0.47
BRAF P15056 2/20 0.47
EPHB6 O15197 1/20 0.47
RAF1 P04049 1/20 0.47
PDGFRB P09619 1/20 0.47
EPHA1 P21709 1/20 0.47
EPHA2 P29317 1/20 0.47
WEE1 P30291 1/20 0.47
TGFBR2 P37173 1/20 0.47
ABL2 P42684 1/20 0.47
FRK P42685 1/20 0.47
MAP2K4 P45985 1/20 0.47
CLK1 P49759 1/20 0.47
LIMK1 P53667 1/20 0.47
EPHB4 P54760 1/20 0.47
DDR1 Q08345 1/20 0.47
MAP3K1 Q13233 1/20 0.47
DYRK1A Q13627 1/20 0.47

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
SCHEMBL30664416 1.00 MAPK14 (0.47) MAPK14ABL1BCRBRAFEPHB6
SCHEMBL21836257 1.00 MAPK14 (0.47) MAPK14ABL1BCRBRAFEPHB6
SCHEMBL21836207 0.89 BRAF (0.45) MAPK14ABL1BCRBRAFEPHB6
SCHEMBL21836208 0.89 BRAF (0.45) MAPK14ABL1BCRBRAFEPHB6
SCHEMBL29320024 0.85 ABL1 (0.51) MAPK14ABL1BCRBRAFEPHB6
SCHEMBL21836270 0.83 BRAF (0.46) MAPK14ABL1BCRBRAFEPHB6
SCHEMBL21836267 0.83 BRAF (0.46) MAPK14ABL1BCRBRAFEPHB6
SCHEMBL21836214 0.83 BRAF (0.46) MAPK14ABL1BCRBRAFEPHB6
SCHEMBL21836213 0.83 BRAF (0.46) MAPK14ABL1BCRBRAFEPHB6
SCHEMBL30664376 0.83 BRAF (0.46) MAPK14ABL1BCRBRAFEPHB6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12129249-B2 Method for producing optically active compound DAY ONE BIOPHARMACEUTICALS, INC. (US) 2024-10-29 US disclosed
EP-4406609-A2 METHOD FOR PRODUCING OPTICALLY ACTIVE COMPOUND Day One Biopharmaceuticals, Inc. (US) 2024-07-31 EP disclosed
EP-3632441-B1 METHOD FOR PRODUCING OPTICALLY ACTIVE COMPOUND DAY ONE BIOPHARMACEUTICALS INC (US) 2024-07-17 EP disclosed
CN-117447464-A Method for producing optically active compound 首日生物制药公司 2024-01-26 CN disclosed
CN-111032047-B Method for producing optically active compound 多特疗法-1公司 2023-10-27 CN disclosed
US-20210347769-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE COMPOUND DAY ONE BIOPHARMACEUTICALS, INC. 2021-11-11 US disclosed
US-10988469-B2 Method for producing optically active compound DOT THERAPEUTICS-1, INC. (US) 2021-04-27 US disclosed
US-20200317659-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE COMPOUND DAY ONE BIOPHARMACEUTICALS, INC. 2020-10-08 US disclosed
CN-111032047-A Process for producing optically active compound 千年制药公司 2020-04-17 CN disclosed
EP-3632441-A2 METHOD FOR PRODUCING OPTICALLY ACTIVE COMPOUND Millennium Pharmaceuticals, Inc. (US) 2020-04-08 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 (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-10988469-B2 Method for producing optically active compound DHPS, QDPR, SPR MAPK14 587/4885ABL1 437/4885BCR 3583/4885
US-20200317659-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE COMPOUND DHPS, QDPR, SPR MAPK14 587/4885ABL1 437/4885BCR 3583/4885
US-12129249-B2 Method for producing optically active compound DHPS, QDPR, SPR MAPK14 587/4885ABL1 437/4885BCR 3583/4885
US-20210347769-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE COMPOUND DHPS, QDPR, SPR MAPK14 587/4885ABL1 437/4885BCR 3583/4885

“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.