SCHEMBL20715718

SCHEMBL20715718

CC(C)Cc1ccc(NC(=O)[C@@H](N)CC(N)=O)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.55
▸ MAPT P10636 1/20 0.55
▸ CRHBP P24387 1/20 0.55
▸ CRHR2 Q13324 1/20 0.55
▸ SMN1; SMN2 Q16637 1/20 0.55
▸ CA12 O43570 1/20 0.52
▸ CA1 P00915 1/20 0.52
▸ CA2 P00918 1/20 0.52
▸ CA4 P22748 1/20 0.52
▸ CA9 Q16790 1/20 0.52
▸ AAK1 Q2M2I8 2/20 0.50
▸ EPHX1 P07099 1/20 0.46
▸ SPHK1 Q9NYA1 5/20 0.46
▸ LARS1 Q9P2J5 1/20 0.45
▸ CXCR1 P25024 1/20 0.44
▸ CXCR2 P25025 1/20 0.44
▸ CIT O14578 1/20 0.44
▸ CHRM1 P11229 1/20 0.44
▸ PDE4A P27815 1/20 0.44
▸ LTA4H P09960 2/20 0.44

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
SCHEMBL20715665 0.88 LTA4H (0.56) GAAMAPTCRHBPCRHR2SMN1; SMN2
SCHEMBL20715888 0.86 GAA (0.56) GAAMAPTCRHBPCRHR2SMN1; SMN2
SCHEMBL20715657 0.85 SPHK1 (0.62) GAAMAPTCRHBPCRHR2SMN1; SMN2
SCHEMBL19234502 0.85 CRHBP (0.51) CRHBPCRHR2SMN1; SMN2AAK1SPHK1
SCHEMBL19375764 0.83 SPHK1 (0.49) CA12CA1CA2AAK1SPHK1
SCHEMBL20715719 0.82 SPHK1 (0.59) SPHK1SPHK2
SCHEMBL20715658 0.81 LTA4H (0.60) GAAMAPTCRHBPCRHR2SMN1; SMN2
SCHEMBL20715478 0.80 MAPT (0.58) GAAMAPTCRHBPCRHR2SMN1; SMN2
SCHEMBL20715479 0.80 MAPT (0.58) GAAMAPTCRHBPCRHR2SMN1; SMN2
Hydrochloric Acid SCHEMBL21724241 0.80 LTA4H (0.51) SMN1; SMN2AAK1SPHK1LARS1CIT

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-20220112242-A1 SOMATOSTATIN RECEPTOR ANTAGONIST COMPOUNDS AND METHODS OF USING THE SAME CDRD VENTURES INC. (CA) 2022-04-14 — — US disclosed
US-11279732-B2 Somatostatin receptor antagonist compounds and methods of using the same CDRD VENTURES INC. (CA) 2022-03-22 — — US disclosed
US-20190040102-A1 SOMATOSTATIN RECEPTOR ANTAGONIST COMPOUNDS AND METHODS OF USING THE SAME CDRD VENTURES INC. (CA) 2019-02-07 — — 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 (3 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-11279732-B2 Somatostatin receptor antagonist compounds and methods of using the same GPR119, SSTR5, SSTR2 GAA 260/4885MAPT 4302/4885CRHBP 259/4885
US-20220112242-A1 SOMATOSTATIN RECEPTOR ANTAGONIST COMPOUNDS AND METHODS OF USING THE SAME GPR119, SSTR5, SSTR2 GAA 265/4885MAPT 4276/4885CRHBP 260/4885
US-20190040102-A1 SOMATOSTATIN RECEPTOR ANTAGONIST COMPOUNDS AND METHODS OF USING THE SAME GPR119, SSTR5, SSTR2 GAA 260/4885MAPT 4302/4885CRHBP 259/4885

“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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