SCHEMBL29887519

SCHEMBL29887519

O=c1c(Cc2ccncc2)nc2c(Cc3ccccc3)[nH]c(-c3ccc(O)cc3)cn1-2

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDC7 O00311 2/20 0.43
▸ GSK3B P49841 2/20 0.38
▸ ABCB1 P08183 1/20 0.38
▸ GCGR P47871 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.35
▸ ADORA3 P0DMS8 2/20 0.35
▸ ADORA1 P30542 2/20 0.35
▸ PARP1 P09874 2/20 0.34
▸ LTB4R Q15722 1/20 0.34
▸ CYP17A1 P05093 1/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ CYP11B1 P15538 1/20 0.34
▸ CYP11B2 P19099 1/20 0.34
▸ MAPK13 O15264 1/20 0.34
▸ RAF1 P04049 1/20 0.34
▸ BRAF P15056 1/20 0.34
▸ MAPK12 P53778 1/20 0.34
▸ MAPK11 Q15759 1/20 0.34
▸ MAPK14 Q16539 1/20 0.34
▸ GRIA1 P42261 2/20 0.34

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
SCHEMBL5558105 0.96 CDC7 (0.46) CDC7GSK3BABCB1GCGRALDH1A1
SCHEMBL954434 0.95 ABCB1 (0.41) CDC7ABCB1ALDH1A1ADORA3ADORA1
SCHEMBL64690 0.94 ABCB1 (0.42) CDC7ABCB1ALDH1A1ADORA3ADORA1
SCHEMBL12293879 0.94 ABCB1 (0.42) CDC7ABCB1ALDH1A1ADORA3ADORA1
SCHEMBL19206652 0.93 CDC7 (0.45) CDC7GSK3BALDH1A1ADORA3LTB4R
SCHEMBL2680751 0.92 ABCB1 (0.40) CDC7ABCB1ALDH1A1ADORA3ADORA1
SCHEMBL10196941 0.89 ABCB1 (0.39) CDC7ABCB1ALDH1A1ADORA3ADORA1
SCHEMBL20841749 0.89 ABCB1 (0.39) CDC7ABCB1ALDH1A1ADORA3ADORA1
SCHEMBL20841761 0.89 ABCB1 (0.39) CDC7ABCB1ALDH1A1ADORA3ADORA1
SCHEMBL10196910 0.89 PARP1 (0.38) CDC7ABCB1ALDH1A1ADORA3ADORA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260077068-A1 ATP-INDEPENDENT BIOLUMINESCENT REPORTER VARIANTS TO IMPROVE IN VIVO IMAGING UNIV VIRGINIA PATENT FOUNDATION (US) 2026-03-19 — — US disclosed
US-20220259574-A1 ATP-INDEPENDENT BIOLUMINESCENT REPORTER VARIANTS TO IMPROVE IN VIVO IMAGING UNIVERSITY OF VIRGINIA PATENT FOUNDATION 2022-08-18 — — 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-20260077068-A1 ATP-INDEPENDENT BIOLUMINESCENT REPORTER VARIANTS TO IMPROVE IN VIVO IMAGING KCNN2, KCNN1, ATP1B2 CDC7 2006/4885GSK3B 1789/4885ABCB1 301/4885

“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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