SCHEMBL22553878

SCHEMBL22553878

COC(=O)c1cc(C2CCC2)on1

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.59
LMNA P02545 1/20 0.59
POLB P06746 1/20 0.59
S1PR3 Q99500 9/20 0.56
STAT1 P42224 3/20 0.53
STAT3 P40763 2/20 0.53
ALDH1A1 P00352 1/20 0.53
HPGD P15428 1/20 0.53
RAB9A P51151 4/20 0.52
S1PR1 P21453 4/20 0.52
NPC1 O15118 3/20 0.52
TSHR P16473 1/20 0.50
HTT P42858 1/20 0.49
HSD17B10 Q99714 1/20 0.49
PSMB8 P28062 1/20 0.47
PSMB9 P28065 1/20 0.47
PSMB5 P28074 1/20 0.47

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
SCHEMBL18810466 0.95 S1PR3 (0.58) SMN1; SMN2LMNAPOLBS1PR3STAT1
SCHEMBL15599243 0.95 S1PR3 (0.58) SMN1; SMN2LMNAPOLBS1PR3STAT1
SCHEMBL20305303 0.93 SMN1; SMN2 (0.65) SMN1; SMN2LMNAPOLBS1PR3STAT1
SCHEMBL21679038 0.85 SMN1; SMN2 (0.57) SMN1; SMN2LMNAPOLBS1PR3STAT1
SCHEMBL21679155 0.84 SMN1; SMN2 (0.56) SMN1; SMN2LMNAPOLBS1PR3STAT1
SCHEMBL892519 0.80 HSD17B10 (0.53) SMN1; SMN2LMNAPOLBS1PR3RAB9A
SCHEMBL31644564 0.80 SMN1; SMN2 (0.49) SMN1; SMN2LMNAPOLBSTAT1STAT3
SCHEMBL22554186 0.80 S1PR3 (0.62) POLBS1PR3STAT1STAT3ALDH1A1
SCHEMBL891991 0.79 S1PR3 (0.55) SMN1; SMN2LMNAPOLBS1PR3RAB9A
SCHEMBL17619253 0.78 S1PR3 (0.60) SMN1; SMN2S1PR3STAT1ALDH1A1HPGD

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11919902-B2 Aryl-bipyridine amine derivatives as phosphatidylinositol phosphate kinase inhibitors HIBERCELL, INC. (US) 2024-03-05 US disclosed
CN-112088157-B Aryl-bipyridylamine derivatives as phosphatidylinositol phosphokinase inhibitors 拉文纳制药公司 2023-12-26 CN disclosed
CN-112088157-A Aryl-bipyridine amine derivatives as phosphoinositide kinase inhibitors 拉文纳制药公司 2020-12-15 CN disclosed
EP-3728230-A1 ARYL-BIPYRIDINE AMINE DERIVATIVES AS PHOSPHATIDYLINOSITOL PHOSPHATE KINASE INHIBITORS Ravenna Pharmaceuticals, Inc. (US) 2020-10-28 EP disclosed
US-20200331913-A1 ARYL-BIPYRIDINE AMINE DERIVATIVES AS PHOSPHATIDYLINOSITOL PHOSPHATE KINASE INHIBITORS HIBERCELL, INC. 2020-10-22 US disclosed
US-20200331913-A1 ARYL-BIPYRIDINE AMINE DERIVATIVES AS PHOSPHATIDYLINOSITOL PHOSPHATE KINASE INHIBITORS HIBERCELL, INC. 2020-10-22 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-20200331913-A1 ARYL-BIPYRIDINE AMINE DERIVATIVES AS PHOSPHATIDYLINOSITOL PHOSPHATE KINASE INHIBITORS PIP5K1A, PIP5K1B, PIP5K1C SMN1; SMN2 3679/4885LMNA 3441/4885POLB 2076/4885
US-11919902-B2 Aryl-bipyridine amine derivatives as phosphatidylinositol phosphate kinase inhibitors PIP5K1A, PIP5K1B, PIP5K1C SMN1; SMN2 3679/4885LMNA 3441/4885POLB 2076/4885

“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.