SCHEMBL18843757

SCHEMBL18843757

CCc1cnc(N2CCC(COc3ccc(C4=CCC(C(=O)O)CC4)cn3)CC2)nc1

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 11/20 0.46
▸ SYK P43405 1/20 0.37
▸ AOC3 Q16853 1/20 0.36
▸ ACHE P22303 2/20 0.35
▸ ACACB O00763 2/20 0.35
▸ PTPN11 Q06124 1/20 0.35
▸ EP300 Q09472 1/20 0.34
▸ DGAT1 O75907 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
SCHEMBL18825493 0.91 GPR119 (0.44) GPR119ACACBPTPN11
SCHEMBL18825441 0.91 GPR119 (0.44) GPR119ACACBEP300
SCHEMBL18601680 0.90 GPR119 (0.54) GPR119AOC3ACACBPTPN11DGAT1
SCHEMBL18825463 0.90 GPR119 (0.44) GPR119ACACBEP300
SCHEMBL18825339 0.89 GPR119 (0.43) GPR119ACACBEP300
SCHEMBL18825471 0.89 GPR119 (0.43) GPR119AOC3ACACB
SCHEMBL18825384 0.88 GPR119 (0.43) GPR119ACACB
SCHEMBL18825515 0.88 GPR119 (0.43) GPR119AOC3ACACB
SCHEMBL20550622 0.86 GPR119 (0.43) GPR119ACACBEP300
SCHEMBL18843840 0.86 GPR119 (0.45) GPR119AOC3PTPN11DGAT1

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 4 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
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

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 1/4885SYK 3048/4885AOC3 4129/4885
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 1/4885SYK 3048/4885AOC3 4129/4885

“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.

Send feedback