SCHEMBL20906151

SCHEMBL20906151

COC(=O)c1ccc(-c2cc(C#N)cc3ccoc23)cc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC22A12 Q96S37 8/20 0.73
XDH P47989 7/20 0.73
EGFR P00533 1/20 0.46
PLAU P00749 2/20 0.44
ERN1 O75460 1/20 0.40
CYP2C8 P10632 1/20 0.40
CYP2C9 P11712 1/20 0.40
MAPT P10636 2/20 0.39
CHRM2 P08172 1/20 0.39
CHRM4 P08173 1/20 0.39
CHRM5 P08912 1/20 0.39
CHRM1 P11229 1/20 0.39
CHRM3 P20309 1/20 0.39
GPR84 Q9NQS5 1/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA9 Q16790 1/20 0.38
CA14 Q9ULX7 1/20 0.38
SLC2A1 P11166 1/20 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
SCHEMBL20906127 0.85 SLC22A12 (0.75) SLC22A12XDHCYP2C8CYP2C9
SCHEMBL18607457 0.85 SLC22A12 (1.00) SLC22A12XDHCYP2C8CYP2C9
SCHEMBL20906107 0.80 SLC22A12 (0.62) SLC22A12XDHCYP2C8CYP2C9
SCHEMBL22630882 0.77 SLC22A12 (0.78) SLC22A12XDHCYP2C8CYP2C9
SCHEMBL18607472 0.77 SLC22A12 (1.00) SLC22A12XDHCYP2C8CYP2C9
SCHEMBL18607217 0.74 SLC22A12 (1.00) SLC22A12XDHCYP2C8CYP2C9
SCHEMBL18607473 0.72 SLC22A12 (0.78) SLC22A12XDHCYP2C8CYP2C9
SCHEMBL18607464 0.72 SLC22A12 (0.78) SLC22A12XDHCYP2C8CYP2C9
SCHEMBL7401479 0.72 CA1 (0.53) XDHPLAUMAPTCA12CA1
SCHEMBL13063631 0.72 CA1 (0.53) XDHPLAUMAPTCA12CA1

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
EP-3344604-B1 CARBOXY SUBSTITUTED (HETERO) AROMATIC RING DERIVATIVES AND PREPARATION METHOD AND USES THEREOF SUNSHINE LAKE PHARMA CO LTD (CN) 2020-11-04 EP disclosed
CN-106478500-B Carboxylic acid substituted (hetero) aromatic ring derivatives, and preparation method and application thereof 广东东阳光药业有限公司 2020-02-11 CN disclosed
US-10266496-B2 Carboxy substituted (hetero) aromatic ring derivatives and preparation method and uses thereof SUNSHINE LAKE PHARMA CO., LTD. (CN) 2019-04-23 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-10266496-B2 Carboxy substituted (hetero) aromatic ring derivatives and preparation method and uses thereof XDH, ABCG2, SLC7A1 SLC22A12 314/4885XDH 1/4885EGFR 4125/4885

“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.