SCHEMBL4209243

SCHEMBL4209243

O=C(O)c1ccc(-c2ccccc2)cc1Nc1cncc2ccccc12

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ACLY P53396 8/20 0.49
▸ CDC25B P30305 2/20 0.47
▸ MAP3K8 P41279 1/20 0.46
▸ ADRA2A P08913 1/20 0.46
▸ ADRA2B P18089 1/20 0.46
▸ ADRA2C P18825 1/20 0.46
▸ ADRA1A P35348 1/20 0.46
▸ KDM4C Q9H3R0 2/20 0.44
▸ KDM5B Q9UGL1 1/20 0.44
▸ DHODH Q02127 2/20 0.44
▸ XDH P47989 1/20 0.43
▸ SLC22A12 Q96S37 1/20 0.43
▸ HNF4A P41235 1/20 0.43
▸ ACMSD Q8TDX5 1/20 0.43
▸ MCL1 Q07820 1/20 0.43

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
Trifluoroacetic Acid SCHEMBL4222841 0.93 ACLY (0.45) ACLYCDC25BMAP3K8ADRA2AADRA2B
SCHEMBL4226821 0.86 KDM4C (0.50) ACLYCDC25BKDM4CKDM5BDHODH
SCHEMBL4222846 0.82 MAP3K8 (0.38) ACLYCDC25BMAP3K8ADRA2AADRA2B
SCHEMBL13890914 0.81 KDM4C (0.46) CDC25BADRA2AADRA2BADRA2CADRA1A
Trifluoroacetic Acid SCHEMBL4213728 0.81 ACLY (0.45) ACLYCDC25BKDM4CKDM5B
Trifluoroacetic Acid SCHEMBL4218342 0.76 CDC25B (0.42) CDC25BADRA2AADRA2BADRA2CADRA1A
SCHEMBL4220149 0.76 XDH (0.48) MAP3K8XDHSLC22A12MCL1
SCHEMBL4222990 0.74 ACLY (0.59) ACLYHNF4AACMSDMCL1
SCHEMBL4223119 0.74 AKR1C3 (0.60) ACLYHNF4AACMSDMCL1
SCHEMBL1317959 0.74 SERPINE1 (0.55) ACLYDHODHMCL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8327467-B2 Anthranilic acid derivative or salt thereof TOYAMA CHEMICAL CO., LTD. (JP) 2012-12-11 — — US disclosed
EP-1860098-B1 NOVEL ANTHRANILIC ACID DERIVATIVE OR SALT THEREOF TOYAMA CHEMICAL CO LTD (JP) 2012-11-14 — — EP disclosed
US-20090105474-A1 NOVEL ANTHRANILIC ACID DERIVATIVE OR SALT THEREOF TOYAMA CHEMICAL CO., LTD. (JP) 2009-04-23 — — US disclosed
EP-1860098-A1 NOVEL ANTHRANILIC ACID DERIVATIVE OR SALT THEREOF TOYAMA CHEMICAL CO., LTD. (JP) 2007-11-28 — — EP 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-20090105474-A1 NOVEL ANTHRANILIC ACID DERIVATIVE OR SALT THEREOF MMP13, MMP11, MMP3 ACLY 430/4885CDC25B 3872/4885MAP3K8 939/4885

“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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