SCHEMBL25168028

SCHEMBL25168028

Cc1c(N)cccc1-c1cccc(-c2ccn3c(=O)c(CN(CCO)C(=O)O)cnc3c2)c1

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 10/20 0.35
▸ KDM4E B2RXH2 2/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ GAA P10253 2/20 0.33
▸ PKM P14618 1/20 0.33
▸ TRPV1 Q8NER1 2/20 0.33
▸ GLA P06280 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ FLT3 P36888 1/20 0.33
▸ FGFR3 P22607 5/20 0.33
▸ PDCD1 Q15116 4/20 0.33
▸ CD274 Q9NZQ7 4/20 0.33
▸ PTGS2 P35354 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
SCHEMBL23725835 0.89 KDR (0.36) KDRKDM4EALDH1A1GAAPKM
SCHEMBL23725543 0.87 ALDH1A1 (0.35) KDRKDM4EALDH1A1GAAPKM
SCHEMBL23726936 0.82 KDR (0.40) KDRKDM4EALDH1A1GAAPKM
SCHEMBL23727338 0.81 JAK2 (0.32) KDRKDM4EALDH1A1GAAPKM
SCHEMBL23725760 0.78 FLT3 (0.34) KDRKDM4EALDH1A1FLT3FGFR3
SCHEMBL25168867 0.76 SSTR4 (0.42) KDRKDM4EALDH1A1GAAPKM
SCHEMBL30432339 0.76 SSTR4 (0.42) KDRKDM4EALDH1A1GAAPKM
SCHEMBL23727423 0.74 HAT1 (0.30) FLT3
SCHEMBL25168030 0.72 SSTR4 (0.42) KDRKDM4EALDH1A1GAAPKM
SCHEMBL30433252 0.72 SSTR4 (0.42) KDRKDM4EALDH1A1GAAPKM

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-20230143612-A1 SUBSTITUTED 1,1'-BIPHENYL COMPOUNDS AND METHODS USING SAME ARBUTUS BIOPHARMA CORP (US) 2023-05-11 — — 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-20230143612-A1 SUBSTITUTED 1,1'-BIPHENYL COMPOUNDS AND METHODS USING SAME HAVCR2, HMBS, VHL KDR 3652/4885KDM4E 224/4885ALDH1A1 172/4885

“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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