SCHEMBL19958205

SCHEMBL19958205

CCOC(=O)c1cc(Cl)nc(N/C=N/O)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 1/20 0.41
▸ CA1 P00915 1/20 0.41
▸ CA2 P00918 1/20 0.41
▸ CA7 P43166 1/20 0.41
▸ CA9 Q16790 1/20 0.41
▸ CA14 Q9ULX7 1/20 0.41
▸ ALDH1A1 P00352 3/20 0.40
▸ SLC2A1 P11166 1/20 0.40
▸ GPR119 Q8TDV5 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ TP53 P04637 1/20 0.39
▸ S1PR2 O95136 1/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ RAB9A P51151 2/20 0.38
▸ MEN1 O00255 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ ALOX15 P16050 1/20 0.38
▸ THRB P10828 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
SCHEMBL19958207 0.88 KDM4E (0.42) CA12CA1CA2CA7CA9
SCHEMBL19959594 0.88 KDM4E (0.42) CA12CA1CA2CA7CA9
SCHEMBL16114233 0.80 GPR35 (0.44) CA12CA1CA2CA7CA9
SCHEMBL15295906 0.80 CA12 (0.46) CA12CA1CA2CA7CA9
SCHEMBL851862 0.79 CA12 (0.58) CA12CA1CA2CA7CA9
SCHEMBL2529771 0.79 NPC1 (0.47) CA12CA1CA2CA7CA9
SCHEMBL22999837 0.76 HPGD (0.52) CA12CA1CA2CA7CA9
SCHEMBL1179728 0.74 CA12 (0.53) CA12CA1CA2CA7CA9
SCHEMBL1179421 0.74 SMN1; SMN2 (0.55) CA12CA1CA2CA7CA9
SCHEMBL8974754 0.73 CA12 (0.56) CA12CA1CA2CA7CA9

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
US-10287286-B2 Compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2019-05-14 — — US disclosed
US-20180072714-A1 Novel Compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2018-03-15 — — US disclosed
US-20180072714-A1 Novel Compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2018-03-15 — — 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 (2 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-20180072714-A1 Novel Compounds F12, HAX1, C1S CA12 1480/4885CA1 2870/4885CA2 1087/4885
US-10287286-B2 Compounds F12, C1S, F3 CA12 1024/4885CA1 1989/4885CA2 537/4885

“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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