SCHEMBL21178006

SCHEMBL21178006

O=c1[nH]cc(F)c(=O)n1COCc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.48
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
TSHR P16473 2/20 0.39
MAPK1 P28482 1/20 0.35
TACR1 P25103 2/20 0.35
TK1 P04183 1/20 0.34
L3MBTL1 Q9Y468 2/20 0.33
ALOX15 P16050 1/20 0.33
KDM4E B2RXH2 1/20 0.33
HPGD P15428 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NSD2 O96028 1/20 0.33
ABL1 P00519 1/20 0.33
PPARG P37231 1/20 0.33
RIN1 Q13671 1/20 0.33
NCOR2 Q9Y618 1/20 0.33
MAPK14 Q16539 1/20 0.33
LMNA P02545 1/20 0.33
NPC1 O15118 1/20 0.33

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
SCHEMBL2786159 0.83 ALDH1A1 (0.54) ALDH1A1CYP2C9CYP2C19TSHRTK1
SCHEMBL11315740 0.79 HPGD (0.50) ALDH1A1L3MBTL1KDM4EHPGDSMN1; SMN2
Hydrogen Sulfide SCHEMBL27583639 0.79 HPGD (0.50) ALDH1A1L3MBTL1KDM4EHPGDSMN1; SMN2
SCHEMBL7013711 0.77 ADRA1D (0.35) LMNAADRA1DADRA1AADRA1BPDE4A
SCHEMBL9394061 0.75 ALDH1A1 (0.51) ALDH1A1CYP2C9CYP2C19TSHRMAPK1
SCHEMBL21190332 0.74 KMT2A (0.46) ALDH1A1CYP2C9CYP2C19TSHRMAPK1
SCHEMBL1781279 0.73 ALDH1A1 (0.53) ALDH1A1CYP2C9CYP2C19TSHRMAPK1
SCHEMBL22632453 0.70 ALDH1A1 (0.47) ALDH1A1CYP2C9CYP2C19TSHRL3MBTL1
SCHEMBL599839 0.70 LMNA (0.36) CYP2C9CYP2C19LMNA
SCHEMBL6719842 0.70 ALDH1A1 (0.52) ALDH1A1CYP2C9CYP2C19TSHRTK1

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
CN-111801339-B 5-Fluorouracil compounds 纽科利制药公司 2025-06-24 CN disclosed
US-11427550-B2 5-fluorouracil compounds NUCORION PHARMACEUTICALS, INC. (US) 2022-08-30 US disclosed
US-20200399227-A1 5-FLUOROURACIL COMPOUNDS NUCORION PHARMACEUTICALS, INC. 2020-12-24 US disclosed
US-20200399227-A1 5-FLUOROURACIL COMPOUNDS NUCORION PHARMACEUTICALS, INC. 2020-12-24 US disclosed
CN-111801339-A 5-fluorouracil compounds 纽科利制药公司 2020-10-20 CN disclosed
WO-2019143860-A1 5-FLUOROURACIL COMPOUNDS NUCORION PHARMACEUTICALS, INC. (US) 2019-07-25 WO disclosed
WO-2019143860-A1 5-FLUOROURACIL COMPOUNDS NUCORION PHARMACEUTICALS, INC. (US) 2019-07-25 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 (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-20200399227-A1 5-FLUOROURACIL COMPOUNDS DPYD, DHFR, FAU ALDH1A1 240/4885CYP2C9 155/4885CYP2C19 272/4885
US-11427550-B2 5-fluorouracil compounds DPYD, DHFR, MTHFD1 ALDH1A1 104/4885CYP2C9 155/4885CYP2C19 192/4885

“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.