SCHEMBL13845545

SCHEMBL13845545

CNc1nc(C(C)=O)c(C)s1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK2 P24941 2/20 0.47
▸ CDK1 P06493 1/20 0.47
▸ CDK3 Q00526 1/20 0.47
▸ GAA P10253 3/20 0.44
▸ GFER P55789 1/20 0.39
▸ SHMT2 P34897 1/20 0.38
▸ ALDH1A1 P00352 3/20 0.37
▸ L3MBTL1 Q9Y468 2/20 0.37
▸ LDHA P00338 1/20 0.37
▸ KMT2A Q03164 3/20 0.37
▸ MEN1 O00255 2/20 0.36
▸ HRH3 Q9Y5N1 1/20 0.35
▸ CCNA2 P20248 1/20 0.35
▸ MAPT P10636 3/20 0.35
▸ RXFP1 Q9HBX9 2/20 0.35
▸ LMNA P02545 2/20 0.35
▸ RAB9A P51151 2/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ CYP1A2 P05177 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
SCHEMBL27331156 0.82 PIK3CG (0.46) GAAALDH1A1KMT2AMEN1MAPT
SCHEMBL23815871 0.82 GAA (0.43) CDK2CDK1CDK3GAAALDH1A1
SCHEMBL25484148 0.81 CDK2 (0.45) CDK2CDK1CDK3GAAGFER
SCHEMBL23815752 0.79 GAA (0.44) CDK2CDK1CDK3GAAGFER
SCHEMBL23682818 0.78 CDK2 (0.43) CDK2CDK1CDK3GAAGFER
SCHEMBL23682669 0.76 GFER (0.36) CDK2CDK1CDK3GAAGFER
SCHEMBL16047133 0.74 ALDH1A1 (0.61) CDK2GAAALDH1A1KMT2AMEN1
SCHEMBL13567165 0.74 HRH3 (0.39) GAAALDH1A1L3MBTL1LDHAKMT2A
SCHEMBL12791571 0.72 HRH3 (0.38) GAAALDH1A1L3MBTL1KMT2AMEN1
SCHEMBL1592594 0.72 RXFP1 (0.62) GAAALDH1A1L3MBTL1KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230285569-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF FRAGILE X Design Therapeutics, Inc. 2023-09-14 — — US disclosed
US-20230285573-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE Design Therapeutics, Inc. 2023-09-14 — — US disclosed
US-20230149550-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE Design Therapeutics, Inc. 2023-05-18 — — US disclosed
US-20230137816-A1 ADMINISTRATION OF CALCIUM CHANNEL TRPC6 INHIBITORS USING BALLOONS, STENTS OR OTHER MEDICAL DEVICES DEUTSCHES HERZZENTRUM MUENCHEN DES FREISTAATES BAYERN (DE) 2023-05-04 — — US disclosed
US-20230050819-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE Design Therapeutics, Inc. 2023-02-16 — — US disclosed
US-20210283265-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE Design Therapeutics, Inc. 2021-09-16 — — US disclosed
US-20210228723-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE Design Therapeutics, Inc. 2021-07-29 — — US disclosed
WO-2009060208-A1 PYRROLOBENZODIAZEPINES SPIROGEN LIMITED (GB) 2009-05-14 — — 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 (7 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-20230137816-A1 ADMINISTRATION OF CALCIUM CHANNEL TRPC6 INHIBITORS USING BALLOONS, STENTS OR OTHER MEDICAL DEVICES TRPC6, TRPC1, ORAI1 CDK2 2299/4885CDK1 2607/4885CDK3 2111/4885
US-20230149550-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE DMPK, DTYMK, MYCBP CDK2 588/4885CDK1 1305/4885CDK3 657/4885
US-20230285573-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE NEDD4, CBL, UBQLN2 CDK2 1489/4885CDK1 1952/4885CDK3 2050/4885
US-20210283265-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE NEDD4, CBL, UBQLN2 CDK2 1489/4885CDK1 1952/4885CDK3 2050/4885
US-20230050819-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE CYFIP2, TPX2, ATXN2 CDK2 1540/4885CDK1 2448/4885CDK3 2826/4885
US-20230285569-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF FRAGILE X CYFIP2, TPX2, CYFIP1 CDK2 1435/4885CDK1 2494/4885CDK3 2710/4885
US-20210228723-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE ZFX, F13B, GRN CDK2 1981/4885CDK1 2325/4885CDK3 1867/4885

“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.

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