SCHEMBL720546

SCHEMBL720546

CCc1cnc(OC2CCC(c3nc(COc4ccc(-n5cnnn5)cc4C)cs3)CC2)nc1

nearest known ligand 0.60

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 17/20 0.60
RXRA P19793 2/20 0.39
GRIN1 Q05586 2/20 0.39
GRIN2B Q13224 2/20 0.39
HPGD P15428 1/20 0.35

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
SCHEMBL718492 0.89 GPR119 (0.75) GPR119RXRAGRIN1GRIN2B
SCHEMBL718771 0.89 GPR119 (0.75) GPR119RXRAGRIN1GRIN2B
SCHEMBL718491 0.89 GPR119 (0.75) GPR119RXRAGRIN1GRIN2B
SCHEMBL1118499 0.87 GPR119 (0.79) GPR119RXRAGRIN1GRIN2B
SCHEMBL3488598 0.83 GPR119 (0.54) GPR119
SCHEMBL3488775 0.78 GPR119 (0.78) GPR119
SCHEMBL13931556 0.78 GPR119 (0.78) GPR119
SCHEMBL3489484 0.78 GPR119 (0.78) GPR119
SCHEMBL717866 0.78 GPR119 (0.57) GPR119RXRAGRIN1GRIN2B
SCHEMBL3489501 0.76 GPR119 (0.75) GPR119RXRAGRIN1GRIN2B

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 GPR119 1/4885RXRA 1623/4885GRIN1 1031/4885

“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.