SCHEMBL718521

SCHEMBL718521

Cc1cnc(OC2CCC(n3cc(COc4ccc(S(C)(=O)=O)cc4)nn3)CC2)nc1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 1/20 0.42
CA12 O43570 9/20 0.40
CA1 P00915 9/20 0.40
CA2 P00918 9/20 0.40
CA9 Q16790 9/20 0.40
RXRA P19793 7/20 0.40
GRIN1 Q05586 7/20 0.40
GRIN2B Q13224 7/20 0.40
CYP19A1 P11511 1/20 0.40
PTGS2 P35354 1/20 0.38
TERT O14746 2/20 0.37
CA5A P35218 2/20 0.37
CA7 P43166 2/20 0.37
CA5B Q9Y2D0 2/20 0.37
GPR119 Q8TDV5 1/20 0.36

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
SCHEMBL718371 0.91 GPR119 (0.42) LOXL2CA12CA1CA2CA9
SCHEMBL720485 0.90 LOXL2 (0.43) LOXL2CA12CA1CA2CA9
Tert-Butyl Formate SCHEMBL28786710 0.74 LOXL2 (0.44) LOXL2CA12CA1CA2CA9
SCHEMBL4289925 0.73 GPR119 (0.61) GPR119
SCHEMBL16242409 0.72 GPR119 (0.46) LOXL2GPR119
SCHEMBL722541 0.67 GPR119 (0.48) CA12CA1CA2CA9CA7
SCHEMBL720852 0.67 GPR119 (0.51) PTGS2GPR119
SCHEMBL22663349 0.64 CYP11B1 (0.36) RXRAGRIN1GRIN2B
SCHEMBL2552046 0.64 GPR119 (0.61) GPR119
SCHEMBL12283329 0.64 GPR119 (0.61) 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
US-20120053180-A1 CYCLOHEXANE ANALOGUES AS GPR119 AGONISTS CHEMIZON, A DIVISION OF OPTOMAGIC CO., LTD. (KR) 2012-03-01 US disclosed
US-20120053180-A1 CYCLOHEXANE ANALOGUES AS GPR119 AGONISTS CHEMIZON, A DIVISION OF OPTOMAGIC CO., LTD. (KR) 2012-03-01 US disclosed
US-20120053180-A1 CYCLOHEXANE ANALOGUES AS GPR119 AGONISTS CHEMIZON, A DIVISION OF OPTOMAGIC CO., LTD. (KR) 2012-03-01 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-20120053180-A1 CYCLOHEXANE ANALOGUES AS GPR119 AGONISTS GPR119, GLP1R, GIPR LOXL2 3276/4885CA12 2010/4885CA1 1372/4885

“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.