SCHEMBL22096850

SCHEMBL22096850

CC(C)(C)c1ncncc1N

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.42
HSP90AA1 P07900 2/20 0.35
CCR9 P51686 1/20 0.34
EGFR P00533 2/20 0.31
CYP19A1 P11511 1/20 0.31

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
Hydrochloric Acid SCHEMBL21543416 0.98 DGAT1 (0.41) DGAT1HSP90AA1CCR9EGFRCYP19A1
SCHEMBL2602384 0.74 DGAT1 (0.35) DGAT1
SCHEMBL1106088 0.74 DGAT1 (0.35) DGAT1CYP19A1
SCHEMBL31505123 0.73 HPGD (0.34) DGAT1
SCHEMBL803486 0.73 DGAT1 (0.34) DGAT1CYP19A1
SCHEMBL8183467 0.73 HPGD (0.34) DGAT1
SCHEMBL21719169 0.73 DGAT1 (0.34) DGAT1
SCHEMBL11092586 0.73 CYP19A1 (0.35) DGAT1CYP19A1
SCHEMBL31505058 0.73 DGAT1 (0.34) DGAT1CCR9
SCHEMBL22907602 0.70 SIRT3 (0.42) DGAT1

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-10875839-B2 Somatostatin modulators and uses thereof Crinetics Pharmaceuticals, Inc. (US) 2020-12-29 US disclosed
US-20200190053-A1 SOMATOSTATIN MODULATORS AND USES THEREOF Crinetics Pharmaceuticals, Inc. 2020-06-18 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-20200190053-A1 SOMATOSTATIN MODULATORS AND USES THEREOF SSTR5, SSTR2, SSTR4 DGAT1 3761/4885HSP90AA1 1289/4885CCR9 3753/4885
US-10875839-B2 Somatostatin modulators and uses thereof SSTR5, SSTR2, SSTR4 DGAT1 3761/4885HSP90AA1 1289/4885CCR9 3753/4885

“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.