SCHEMBL22801947

SCHEMBL22801947

CN(Cc1ccccc1)C1CC(n2ccc3ccc(N4CCN(c5ccc(S(C)(=O)=O)cc5)CC4)nc32)C1

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 5/20 0.39
▸ KDM4E B2RXH2 1/20 0.38
▸ RORC P51449 7/20 0.37
▸ RXFP1 Q9HBX9 2/20 0.36
▸ PTGS2 P35354 1/20 0.36
▸ CNR1 P21554 1/20 0.36
▸ CNR2 P34972 1/20 0.36
▸ HSD11B1 P28845 1/20 0.35

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
SCHEMBL21274382 1.00 GPR119 (0.39) GPR119KDM4ERORCRXFP1PTGS2
SCHEMBL21273979 1.00 GPR119 (0.39) GPR119KDM4ERORCRXFP1PTGS2
SCHEMBL21281595 0.88 MAPT (0.38) RORCCNR1CNR2
SCHEMBL22801915 0.86 GPR119 (0.41) GPR119RXFP1HSD11B1
SCHEMBL22801952 0.86 GPR119 (0.41) GPR119RXFP1HSD11B1
SCHEMBL21274013 0.86 GPR119 (0.41) GPR119RXFP1HSD11B1
SCHEMBL21281594 0.85 AURKA (0.33) RORCCNR1CNR2
SCHEMBL21285514 0.82 JAK2 (0.35) RORCCNR1CNR2
SCHEMBL22801948 0.80 GPR119 (0.42) GPR119RXFP1HSD11B1
SCHEMBL21274200 0.80 GPR119 (0.42) GPR119RXFP1HSD11B1

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-20200399268-A1 Pharmaceutical 6,5 Heterobicyclic Ring Derivatives EVOTEC (UK) LTD (GB) 2020-12-24 — — US claimed
CN-112105357-A Pharmaceutically acceptable 6,5 heterobicyclic derivatives UCB生物制药有限责任公司 2020-12-18 — — CN claimed
US-20200399268-A1 Pharmaceutical 6,5 Heterobicyclic Ring Derivatives EVOTEC (UK) LTD (GB) 2020-12-24 — — US disclosed
CN-112105357-A Pharmaceutically acceptable 6,5 heterobicyclic derivatives UCB生物制药有限责任公司 2020-12-18 — — CN 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-20200399268-A1 Pharmaceutical 6,5 Heterobicyclic Ring Derivatives STING1, IRF3, NFATC1 GPR119 388/4885KDM4E 1908/4885RORC 28/4885

“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.

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