SCHEMBL10272681

SCHEMBL10272681

Cc1ccc(CN2CCC[C@@H]2C(=O)O)cc1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ CD274 Q9NZQ7 7/20 0.53
▸ PDCD1 Q15116 3/20 0.53
▸ NPBWR1 P48145 1/20 0.50
▸ MCHR1 Q99705 1/20 0.50
▸ SMN1; SMN2 Q16637 1/20 0.50
▸ CYP1A2 P05177 1/20 0.50
▸ CYP2C19 P33261 2/20 0.49
▸ KDM4E B2RXH2 1/20 0.49
▸ ALDH1A1 P00352 1/20 0.49
▸ L3MBTL1 Q9Y468 1/20 0.48
▸ S1PR1 P21453 1/20 0.48
▸ S1PR5 Q9H228 1/20 0.48
▸ NAMPT P43490 1/20 0.47
▸ SPHK1 Q9NYA1 1/20 0.47
▸ CYP3A4 P08684 1/20 0.47
▸ CYP2C9 P11712 1/20 0.47
▸ PKM P14618 1/20 0.47
▸ HRH3 Q9Y5N1 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
SCHEMBL2036101 1.00 CD274 (0.53) CD274PDCD1NPBWR1MCHR1SMN1; SMN2
SCHEMBL1819166 1.00 CD274 (0.53) CD274PDCD1NPBWR1MCHR1SMN1; SMN2
SCHEMBL3148407 0.86 CYP1A2 (0.51) CD274PDCD1NPBWR1MCHR1SMN1; SMN2
SCHEMBL1817183 0.86 CYP1A2 (0.51) CD274PDCD1NPBWR1MCHR1SMN1; SMN2
SCHEMBL2032294 0.86 CYP1A2 (0.51) CD274PDCD1NPBWR1MCHR1SMN1; SMN2
SCHEMBL1819248 0.86 CYP1A2 (0.60) CD274PDCD1MCHR1SMN1; SMN2CYP1A2
SCHEMBL1972076 0.86 CYP1A2 (0.60) CD274PDCD1MCHR1SMN1; SMN2CYP1A2
SCHEMBL2587055 0.86 CYP1A2 (0.60) CD274PDCD1MCHR1SMN1; SMN2CYP1A2
SCHEMBL2032635 0.85 CYP1A2 (0.50) CD274PDCD1SMN1; SMN2CYP1A2CYP2C19
SCHEMBL1819133 0.85 IDO1 (0.53) CD274PDCD1SMN1; SMN2CYP1A2CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1957498-B1 INHIBITORS OF VEGF RECEPTOR AND HGF RECEPTOR SIGNALING METHYLGENE INC (CA) 2017-02-15 — — EP disclosed
US-8329726-B2 Inhibitors of VEGF receptor and HGF receptor signaling METHYLGENE INC. (CA) 2012-12-11 — — US disclosed
US-20120083482-A1 INHIBITORS OF VEGF RECEPTOR AND HGF RECEPTOR SIGNALING METHYLGENE INC. 2012-04-05 — — US disclosed
US-8093264-B2 Fused heterocycles as inhibitors of VEGF receptor and HGF receptor signaling METHYLGENE INC. (CA) 2012-01-10 — — US disclosed
US-20080255155-A1 KINASE INHIBITORS AND USES THEREOF METHLYGENE INC. (CA) 2008-10-16 — — US disclosed
US-20080064718-A1 INHIBITORS OF PROTEIN TYROSINE KINASE ACTIVITY METHYLGENE INC. (CA) 2008-03-13 — — US disclosed
US-20070004675-A1 Inhibitors of VEGF receptor and HGF receptor signaling METHYLGENE, INC. 2007-01-04 — — 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 (4 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-20070004675-A1 Inhibitors of VEGF receptor and HGF receptor signaling HGF, MET, FLT1 CD274 581/4885PDCD1 1450/4885NPBWR1 685/4885
US-20120083482-A1 INHIBITORS OF VEGF RECEPTOR AND HGF RECEPTOR SIGNALING HGF, MET, KDR CD274 1320/4885PDCD1 2225/4885NPBWR1 355/4885
US-20080255155-A1 KINASE INHIBITORS AND USES THEREOF ABL1, MAP3K20, MAP3K1 CD274 1500/4885PDCD1 1014/4885NPBWR1 4354/4885
US-20080064718-A1 INHIBITORS OF PROTEIN TYROSINE KINASE ACTIVITY HGF, ERBB2, MET CD274 984/4885PDCD1 1293/4885NPBWR1 2501/4885

“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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