SCHEMBL717508

SCHEMBL717508

CCc1cnc(OC2CCC(c3nc(COc4ccc(C(F)(F)F)cc4)cs3)CC2)nc1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 12/20 0.49
RXRA P19793 2/20 0.37
GRIN1 Q05586 2/20 0.37
GRIN2B Q13224 2/20 0.37
LMNA P02545 1/20 0.36
TP53 P04637 1/20 0.36
ALOX5 P09917 1/20 0.35
PSEN1 P49768 1/20 0.35
PRMT5 O14744 1/20 0.35
SLC6A5 Q9Y345 1/20 0.34
MAOB P27338 1/20 0.34
PPARG P37231 1/20 0.34
PPARA Q07869 1/20 0.34

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
SCHEMBL720852 0.84 GPR119 (0.51) GPR119LMNA
SCHEMBL721511 0.82 GPR119 (0.46) GPR119LMNA
SCHEMBL718518 0.81 GPR119 (0.53) GPR119RXRAGRIN1GRIN2B
SCHEMBL718771 0.81 GPR119 (0.75) GPR119RXRAGRIN1GRIN2BTP53
SCHEMBL718492 0.81 GPR119 (0.75) GPR119RXRAGRIN1GRIN2BTP53
SCHEMBL720840 0.81 GPR119 (0.57) GPR119RXRAGRIN1GRIN2B
SCHEMBL717866 0.81 GPR119 (0.57) GPR119RXRAGRIN1GRIN2B
SCHEMBL718491 0.81 GPR119 (0.75) GPR119RXRAGRIN1GRIN2BTP53
SCHEMBL719546 0.79 RAB9A (0.40) GPR119
SCHEMBL718507 0.75 GPR119 (0.49) 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 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.