SCHEMBL20906115

SCHEMBL20906115

N#Cc1cc(Br)c2sccc2c1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
XDH P47989 1/20 0.45
SLC22A12 Q96S37 1/20 0.45
MEN1 O00255 1/20 0.44
TTR P02766 1/20 0.44
ALB P02768 1/20 0.44
KMT2A Q03164 1/20 0.44
HTT P42858 1/20 0.34
IMPDH2 P12268 1/20 0.31
IMPDH1 P20839 1/20 0.31
CYP2A6 P11509 1/20 0.31
PTPN1 P18031 2/20 0.31
PTPN2 P17706 1/20 0.31
CSNK2A1 P68400 1/20 0.30

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
SCHEMBL19436068 0.78 XDH (0.45) XDHSLC22A12IMPDH2IMPDH1CYP2A6
SCHEMBL1982101 0.78 XDH (0.55) XDHSLC22A12MEN1TTRALB
SCHEMBL19436147 0.78 XDH (0.45) XDHSLC22A12IMPDH2IMPDH1CYP2A6
SCHEMBL4257583 0.73 SLC22A12 (0.64) XDHSLC22A12HTTCSNK2A1
SCHEMBL30489922 0.72 ALDH1A1 (0.33) CYP2A6
SCHEMBL6598624 0.72 ALDH1A1 (0.33) CYP2A6
SCHEMBL12135667 0.71 CYP1A2 (0.32) XDHCYP2A6
SCHEMBL1356275 0.71 CASP3 (0.32)
SCHEMBL31573234 0.71 MAPT (0.41) MEN1KMT2A
SCHEMBL20906119 0.70 XDH (0.45) XDHSLC22A12MEN1TTRALB

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 XDH 1/4885SLC22A12 314/4885MEN1 4506/4885

“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.