SCHEMBL719546

SCHEMBL719546

CCc1cnc(OC2CCC(c3nc(CCl)cs3)CC2)nc1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.40
NPC1 O15118 2/20 0.40
POLB P06746 1/20 0.40
GAA P10253 1/20 0.40
KDM4E B2RXH2 5/20 0.40
MAPT P10636 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
GPR119 Q8TDV5 9/20 0.40
ALDH1A1 P00352 4/20 0.34
TDP1 Q9NUW8 3/20 0.34
SLC6A3 Q01959 2/20 0.34
DRD2 P14416 1/20 0.33
HTR2A P28223 1/20 0.33
GFER P55789 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
SCHEMBL717508 0.79 GPR119 (0.49) GPR119
SCHEMBL720852 0.78 GPR119 (0.51) GPR119
SCHEMBL1118249 0.78 GPR119 (0.58) RAB9ANPC1POLBGAAKDM4E
SCHEMBL722586 0.77 GPR119 (0.39) GPR119
SCHEMBL720919 0.77 GPR119 (0.39) GPR119
SCHEMBL1062975 0.76 SLC6A3 (0.48) RAB9ANPC1POLBGAAKDM4E
SCHEMBL719355 0.76 GPR119 (0.38) GPR119
SCHEMBL719354 0.76 GPR119 (0.38) GPR119
SCHEMBL721511 0.76 GPR119 (0.46) RAB9ANPC1SMN1; SMN2GPR119ALDH1A1
SCHEMBL720840 0.75 GPR119 (0.57) 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 RAB9A 1410/4885NPC1 684/4885POLB 4720/4885

“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.