SCHEMBL720786

SCHEMBL720786

CCc1cnc(OC2CCC(NC(=O)c3ccc(-c4ccc(S(C)(=O)=O)cc4)cc3F)CC2)nc1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 4/20 0.41
RIPK2 O43353 1/20 0.40
MAPK1 P28482 4/20 0.40
ALDH1A1 P00352 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HRH3 Q9Y5N1 1/20 0.39
PDE4B Q07343 1/20 0.39
PRKAA2 P54646 1/20 0.39
CNR2 P34972 1/20 0.39
PTGS2 P35354 1/20 0.38
ATR Q13535 1/20 0.38
ACACB O00763 1/20 0.38
PIK3CA P42336 1/20 0.38
MTOR P42345 1/20 0.38
NAAA Q02083 1/20 0.38
USP30 Q70CQ3 1/20 0.37

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
SCHEMBL10052773 0.89 CHRM4 (0.43) HRH3PDE4BCNR2ACACBPIK3CA
SCHEMBL720225 0.81 GPR119 (0.44) GPR119PTGS2ACACB
SCHEMBL720913 0.78 KMT2A (0.47) RIPK2MAPK1ALDH1A1SMN1; SMN2HRH3
SCHEMBL720914 0.78 KMT2A (0.47) RIPK2MAPK1ALDH1A1SMN1; SMN2HRH3
SCHEMBL718622 0.77 HRH3 (0.41) RIPK2MAPK1ALDH1A1SMN1; SMN2HRH3
SCHEMBL717665 0.71 KMT2A (0.43) GPR119MAPK1ACACB
SCHEMBL718769 0.70 CTSK (0.37) GPR119ALDH1A1CNR2PTGS2
SCHEMBL719665 0.69 NPC1 (0.52) PTGS2
SCHEMBL722541 0.68 GPR119 (0.48) GPR119
SCHEMBL719749 0.67 KMT2A (0.51) GPR119ALDH1A1PRKAA2

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 1/4885RIPK2 2601/4885MAPK1 1482/4885

“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.