SCHEMBL721511

SCHEMBL721511

CCc1cnc(OC2CCC(c3nc(COc4ccc(NS(C)(=O)=O)cc4)cs3)CC2)nc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 13/20 0.46
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
AR P10275 2/20 0.39
HPGD P15428 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
LMNA P02545 1/20 0.36
MAPK1 P28482 1/20 0.36
CTPS1 P17812 1/20 0.34
ALDH1A1 P00352 1/20 0.32
PKM P14618 1/20 0.32
CACNA1F O60840 1/20 0.32
CHRM2 P08172 1/20 0.32
ACHE P22303 1/20 0.32
AGTR1 P30556 1/20 0.32
DRD3 P35462 1/20 0.32
CACNA1D Q01668 1/20 0.32
KCNH2 Q12809 1/20 0.32
CACNA1S Q13698 1/20 0.32
CACNA1C Q13936 1/20 0.32

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 0.89 GPR119 (0.51) GPR119LMNAPKM
SCHEMBL1118361 0.84 GPR119 (0.65) GPR119NPC1RAB9AARHPGD
SCHEMBL717508 0.82 GPR119 (0.49) GPR119LMNA
SCHEMBL720919 0.80 GPR119 (0.39) GPR119
SCHEMBL718771 0.78 GPR119 (0.75) GPR119ALDH1A1
SCHEMBL718518 0.78 GPR119 (0.53) GPR119
SCHEMBL720840 0.78 GPR119 (0.57) GPR119
SCHEMBL717866 0.78 GPR119 (0.57) GPR119
SCHEMBL718491 0.78 GPR119 (0.75) GPR119ALDH1A1
SCHEMBL718492 0.78 GPR119 (0.75) GPR119ALDH1A1

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 1/4885NPC1 684/4885RAB9A 1410/4885

“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.