SCHEMBL16627262

SCHEMBL16627262

CN(CC1CCN(C(=O)OC(C)(C)C)CC1)S(=O)(=O)c1ccc(C#N)cc1

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 14/20 0.53
LIMK2 P53671 1/20 0.51
FNTA P49354 1/20 0.49
FNTB P49356 1/20 0.49
TGFBR1 P36897 1/20 0.45
KDM1A O60341 1/20 0.45

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
SCHEMBL7662750 0.86 LIMK2 (0.53) GPR119LIMK2TGFBR1
SCHEMBL16617023 0.85 KDM1A (0.49) LIMK2KDM1A
SCHEMBL15229274 0.82 TGFBR1 (0.61) GPR119TGFBR1
SCHEMBL16616925 0.81 GPR119 (0.65) GPR119LIMK2
SCHEMBL16627263 0.80 HTR2C (0.48) KDM1A
SCHEMBL15232168 0.79 GPR119 (0.59) GPR119
SCHEMBL3146175 0.78 GPR119 (0.60) GPR119
SCHEMBL3096959 0.78 GPR119 (0.67) GPR119
SCHEMBL7723348 0.78 GPR119 (0.60) GPR119
SCHEMBL20015578 0.77 GPR119 (0.59) GPR119

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
EP-2822656-B1 3-ARYL-5-SUBSTITUTED-ISOQUINOLIN-1-ONE COMPOUNDS AND THEIR THERAPEUTIC USE CANCER RES INST ROYAL (GB) 2016-10-19 EP disclosed
US-9193689-B2 3-aryl-5-substituted-isoquinolin-1-one compounds and their therapeutic use INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (THE) (GB) 2015-11-24 US disclosed
US-20150099732-A1 3-ARYL-5-SUBSTITUTED-ISOQUINOLIN-1-ONE COMPOUNDS AND THEIR THERAPEUTIC USE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (THE) (GB) 2015-04-09 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 (1 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-20150099732-A1 3-ARYL-5-SUBSTITUTED-ISOQUINOLIN-1-ONE COMPOUNDS AND THEIR THERAPEUTIC USE TNKS, TNKS2, PARP11 GPR119 2578/4885LIMK2 99/4885FNTA 2052/4885

“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.