SCHEMBL27199331

SCHEMBL27199331

CC(C)n1ccc2c(c(NC(=O)O)cn2C)c1=O

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCNT1 O60563 1/20 0.32
CCNA2 P20248 1/20 0.32
CDK2 P24941 1/20 0.32
CDK9 P50750 1/20 0.32
CMA1 P23946 4/20 0.31
CTSG P08311 1/20 0.31
MAPK11 Q15759 1/20 0.31
MAPK14 Q16539 1/20 0.31
ALDH1A1 P00352 2/20 0.30
POLB P06746 2/20 0.30
MAPT P10636 2/20 0.30
MAPK1 P28482 1/20 0.30
THRB P10828 1/20 0.30
BRPF1 P55201 1/20 0.30
CYP2C9 P11712 1/20 0.30
PTGDR Q13258 1/20 0.30
PTGDR2 Q9Y5Y4 1/20 0.30
MTNR1A P48039 1/20 0.30
MTNR1B P49286 1/20 0.30
GAA P10253 1/20 0.30

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
SCHEMBL27199631 0.86 MAP3K5 (0.37)
SCHEMBL27199393 0.84 KDM4E (0.36) CMA1CTSGPOLBMAPTTHRB
SCHEMBL25750429 0.83 ELANE (0.38) MAPK14
SCHEMBL27199516 0.78 KDM4E (0.35) MAPTTHRB
SCHEMBL27199323 0.76 ALDH1A1 (0.34) ALDH1A1MAPTMAPK1CYP2C9GAA
SCHEMBL27199319 0.75 TP53 (0.39) ALDH1A1MAPTGAA
SCHEMBL27199595 0.75 MET (0.35) MAPK1
SCHEMBL27199346 0.74 ALDH1A1 (0.38) ALDH1A1POLBMAPTMAPK1CYP2C9
SCHEMBL25750427 0.74 CCNT1 (0.33) CCNT1CCNA2CDK2CDK9ALDH1A1
Hydrochloric Acid SCHEMBL27199567 0.73 CCNT1 (0.32) CCNT1CCNA2CDK2CDK9ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240124448-A1 TYK2 INHIBITORS AND COMPOSITIONS AND METHODS THEREOF LYNK PHARMACEUTICALS CO. LTD. (CN) 2024-04-18 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 (1 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-20240124448-A1 TYK2 INHIBITORS AND COMPOSITIONS AND METHODS THEREOF TYK2, JAK2, JAK1 CCNT1 3613/4885CCNA2 3235/4885CDK2 351/4885

“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.