SCHEMBL22001982

SCHEMBL22001982

NCCNC(=O)N[C@@H](CO)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ TGFBR1 P36897 3/20 0.50
▸ FOLH1 Q04609 4/20 0.41
▸ NAALAD2 Q9Y3Q0 3/20 0.41
▸ MAPT P10636 1/20 0.41
▸ GGT1 P19440 1/20 0.40
▸ RIMKLA Q8IXN7 1/20 0.38
▸ CA2 P00918 2/20 0.38
▸ CA1 P00915 1/20 0.38
▸ MME P08473 3/20 0.38

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
SCHEMBL19360075 0.83 FOLH1 (0.44) FOLH1NAALAD2MAPTGGT1RIMKLA
SCHEMBL8472248 0.81 FOLH1 (0.52) TGFBR1FOLH1NAALAD2MAPTRIMKLA
SCHEMBL8472243 0.81 FOLH1 (0.52) TGFBR1FOLH1NAALAD2MAPTRIMKLA
SCHEMBL18538622 0.80 FPR2 (0.47) FOLH1NAALAD2MAPTGGT1RIMKLA
SCHEMBL2742767 0.80 FOLH1 (0.67) FOLH1NAALAD2RIMKLA
SCHEMBL19788058 0.80 FOLH1 (0.67) FOLH1NAALAD2RIMKLA
SCHEMBL18756213 0.78 EPHX1 (0.33) —
SCHEMBL31690474 0.78 TGFBR1 (0.52) TGFBR1FOLH1NAALAD2MAPTRIMKLA
Hydrochloric Acid SCHEMBL18725668 0.76 MEN1 (0.34) —
SCHEMBL880551 0.75 GGT1 (0.58) TGFBR1FOLH1GGT1CA2CA1

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-10654815-B2 Urea compound and preparation method and application thereof SHENZHEN CHIPSCREEN BIOSCIENCES CO., LTD. (CN) 2020-05-19 — — 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 (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-10654815-B2 Urea compound and preparation method and application thereof PDCD1, CD274, PDCD10 TGFBR1 1440/4885FOLH1 4126/4885NAALAD2 3626/4885

“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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