SCHEMBL461992

SCHEMBL461992

CC(C)c1noc(N2CCC(COc3ccc(Br)cn3)CC2)n1

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 17/20 0.55
GPR183 P32249 1/20 0.54
ABCB1 P08183 1/20 0.39
ABCC1 P33527 1/20 0.39
ABCG2 Q9UNQ0 1/20 0.39
CNR2 P34972 1/20 0.38
KCNH2 Q12809 1/20 0.38
ACACB O00763 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
SCHEMBL470560 0.88 GPR119 (0.55) GPR119GPR183ABCB1ABCC1ABCG2
SCHEMBL461663 0.86 GPR119 (0.54) GPR119GPR183ABCB1ABCC1ABCG2
SCHEMBL387558 0.86 GPR119 (0.66) GPR119GPR183ABCB1ABCC1ABCG2
SCHEMBL11956900 0.86 GPR119 (0.54) GPR119GPR183CNR2ACACB
SCHEMBL456972 0.84 GPR119 (0.53) GPR119GPR183CNR2
SCHEMBL119721 0.84 GPR119 (0.46) GPR119GPR183KCNH2
SCHEMBL149049 0.84 GPR119 (0.46) GPR119GPR183KCNH2
SCHEMBL11978475 0.84 GPR119 (0.52) GPR119GPR183CNR2ACACB
SCHEMBL1092906 0.83 GPR119 (0.58) GPR119GPR183KCNH2ACACB
SCHEMBL470450 0.82 GPR119 (0.54) GPR119GPR183ABCB1ABCC1ABCG2

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10723699-B2 Cyclohexene derivative, preparation method thereof, and pharmaceutical composition for preventing or treating metabolic disease comprising the same as active ingredient HYUNDAI PHARM CO., LTD. (KR) 2020-07-28 US disclosed
US-10723699-B2 Cyclohexene derivative, preparation method thereof, and pharmaceutical composition for preventing or treating metabolic disease comprising the same as active ingredient HYUNDAI PHARM CO., LTD. (KR) 2020-07-28 US disclosed
US-20180318274-A1 CYCLOHEXENE DERIVATIVE, PREPARATION METHOD THEREOF, AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING METABOLIC DISEASE COMPRISING THE SAME AS ACTIVE INGREDIENT HYUNDAI PHARM CO., LTD. (KR) 2018-11-08 US disclosed
EP-3352750-A1 CYCLOHEXENE DERIVATIVE, PREPARATION METHOD THEREOF, AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING METABOLIC DISEASE COMPRISING THE SAME AS ACTIVE INGREDIENT Hyundai Pharm Co., Ltd. (KR) 2018-08-01 EP disclosed
WO-2017078352-A1 CYCLOHEXENE DERIVATIVE, PREPARATION METHOD THEREOF, AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING METABOLIC DISEASE COMPRISING THE SAME AS ACTIVE INGREDIENT HYUNDAI PHARM CO., LTD. (KR) 2017-05-11 WO disclosed
WO-2017078352-A1 CYCLOHEXENE DERIVATIVE, PREPARATION METHOD THEREOF, AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING METABOLIC DISEASE COMPRISING THE SAME AS ACTIVE INGREDIENT HYUNDAI PHARM CO., LTD. (KR) 2017-05-11 WO disclosed
WO-2011147951-A1 CYCLOAMINO DERIVATIVES AS GPR119 ANTAGONISTS PROSIDION LIMITED (GB) 2011-12-01 WO 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 (2 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-10723699-B2 Cyclohexene derivative, preparation method thereof, and pharmaceutical composition for preventing or treating metabolic disease comprising the same as active ingredient GPR119, GLP1R, GCGR GPR119 1/4885GPR183 19/4885ABCB1 2062/4885
US-20180318274-A1 CYCLOHEXENE DERIVATIVE, PREPARATION METHOD THEREOF, AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING METABOLIC DISEASE COMPRISING THE SAME AS ACTIVE INGREDIENT GPR119, GLP1R, GCGR GPR119 1/4885GPR183 19/4885ABCB1 2062/4885

“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.