SCHEMBL21709897

SCHEMBL21709897

CC(C)(C)c1nccc(/C=N/O)c1N

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ ALOX12 P18054 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ ALDH1A1 P00352 2/20 0.33
▸ FGF23 Q9GZV9 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.32
▸ ALOX15 P16050 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ HTT P42858 1/20 0.32

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
SCHEMBL22096855 0.81 KDR (0.32) —
SCHEMBL21709863 0.77 NOS3 (0.31) —
SCHEMBL17075277 0.77 CCR1 (0.41) ALDH1A1
SCHEMBL22096810 0.76 ALOX12 (0.49) SMN1; SMN2ALOX12MAPTALDH1A1FGF23
SCHEMBL21173560 0.73 ALDH1A1 (0.33) ALDH1A1FGF23KDM4EALOX15L3MBTL1
SCHEMBL21709866 0.69 NOS2 (0.56) MAPTKDM4E
SCHEMBL12479706 0.68 HTT (0.33) SMN1; SMN2ALOX12MAPTALDH1A1FGF23
SCHEMBL12479704 0.68 HTT (0.33) SMN1; SMN2ALOX12MAPTALDH1A1FGF23
SCHEMBL22096897 0.67 NOS3 (0.34) KDM4E
SCHEMBL16962638 0.64 MAPT (0.58) SMN1; SMN2MAPTALDH1A1FGF23KDM4E

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-10889561-B2 Process of making somatostatin modulators Crinetics Pharmaceuticals, Inc. (US) 2021-01-12 — — US disclosed
US-20200048219-A1 PROCESS OF MAKING SOMATOSTATIN MODULATORS Crinetics Pharmaceuticals, Inc. 2020-02-13 — — 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-20200048219-A1 PROCESS OF MAKING SOMATOSTATIN MODULATORS SSTR5, SSTR4, SSTR2 SMN1; SMN2 869/4885ALOX12 1316/4885MAPT 3475/4885
US-10889561-B2 Process of making somatostatin modulators SSTR5, SSTR4, SSTR2 SMN1; SMN2 869/4885ALOX12 1316/4885MAPT 3475/4885

“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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