SCHEMBL21883271

SCHEMBL21883271

Cc1nc2ccc(F)c(CC=O)c2n(C)c1=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.37
GLA P06280 3/20 0.37
HPGD P15428 3/20 0.37
KDM4E B2RXH2 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
CYP1A2 P05177 11/20 0.34
HSD17B10 Q99714 6/20 0.34
TSHR P16473 4/20 0.34
USP2 O75604 4/20 0.34
MAPK1 P28482 3/20 0.34
CASP1 P29466 3/20 0.34
CASP7 P55210 3/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
CYP2D6 P10635 2/20 0.34
CLK4 Q9HAZ1 1/20 0.34
CYP3A4 P08684 6/20 0.33
CYP2C9 P11712 2/20 0.32
CYP2C19 P33261 2/20 0.32
CYP11B2 P19099 1/20 0.31

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
SCHEMBL21820181 0.88 ALDH1A1 (0.36) ALDH1A1GLAHPGDKDM4ESMN1; SMN2
SCHEMBL25015333 0.80 CYP1A2 (0.39) ALDH1A1GLAHPGDKDM4ESMN1; SMN2
SCHEMBL22490597 0.78 ALDH1A1 (0.38) ALDH1A1GLAHPGDKDM4ESMN1; SMN2
SCHEMBL21820192 0.77 CYP1A2 (0.33) ALDH1A1GLAHPGDCYP1A2HSD17B10
SCHEMBL21820229 0.76 ALDH1A1 (0.41) ALDH1A1GLAHPGDKDM4ESMN1; SMN2
SCHEMBL22490588 0.76 ALDH1A1 (0.41) ALDH1A1GLAHPGDKDM4ESMN1; SMN2
SCHEMBL30448226 0.76 ALDH1A1 (0.41) ALDH1A1GLAHPGDKDM4ESMN1; SMN2
SCHEMBL3102060 0.73 BRPF1 (0.35)
SCHEMBL30237334 0.73 BRPF1 (0.35)
SCHEMBL30893480 0.72 ALDH1A1 (0.44) ALDH1A1GLAHPGDKDM4ESMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110382505-B Heterocyclic compounds useful as antibacterial agents and process for producing the same 巴格沃克斯研究有限公司 2023-04-04 CN disclosed
EP-3634968-B1 HETEROCYCLIC COMPOUNDS USEFUL AS ANTI-BACTERIAL AGENTS AND METHOD FOR PRODUCTION THEREOF BUGWORKS RES INC (US) 2023-01-25 EP disclosed
US-10912780-B2 Heterocyclic compounds useful as anti-bacterial agents and method for production thereof Bugworks Research, Inc. (US) 2021-02-09 US disclosed
US-20200085834-A1 HETEROCYCLIC COMPOUNDS USEFUL AS ANTI-BACTERIAL AGENTS AND METHOD FOR PRODUCTION THEREOF Bugworks Research, Inc. 2020-03-19 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 (2 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-20200085834-A1 HETEROCYCLIC COMPOUNDS USEFUL AS ANTI-BACTERIAL AGENTS AND METHOD FOR PRODUCTION THEREOF UROD, ALPI, HLA-A ALDH1A1 1655/4885GLA 65/4885HPGD 88/4885
US-10912780-B2 Heterocyclic compounds useful as anti-bacterial agents and method for production thereof UROD, ALPI, HLA-A ALDH1A1 1655/4885GLA 65/4885HPGD 88/4885

“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.