SCHEMBL21178000

SCHEMBL21178000

CC(C)N(C(C)C)P(OCc1cc(F)cc(F)c1)N(C(C)C)C(C)C

nearest known ligand 0.42

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.42
MAOB P27338 1/20 0.35
TACR1 P25103 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
SCHEMBL21178030 0.83 IDO1 (0.49) IDO1MAOB
SCHEMBL21177998 0.82 IDO1 (0.42) IDO1MAOB
SCHEMBL21178110 0.81 MMP1 (0.30)
SCHEMBL21178107 0.80 TACR1 (0.36) TACR1
SCHEMBL21179052 0.78 MAOB (0.39) MAOB
SCHEMBL2252915 0.74 TSHR (0.41) IDO1
SCHEMBL22801228 0.74 DPP4 (0.40)
SCHEMBL21178902 0.73 IDO1 (0.49) IDO1MAOB
SCHEMBL21177999 0.73 TDP1 (0.33) IDO1
SCHEMBL21178831 0.72

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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 IDO1 4055/4885MAOB 846/4885TACR1 4884/4885
US-11427550-B2 5-fluorouracil compounds DPYD, DHFR, MTHFD1 IDO1 3948/4885MAOB 808/4885TACR1 4867/4885

“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.