SCHEMBL21274044

SCHEMBL21274044

CNC(=O)c1cn([C@H]2C[C@@H](NC)C2)c2nc(N3CCN(c4ccc(S(C)(=O)=O)cc4)CC3)ccc12

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ HSD11B1 P28845 3/20 0.41
▸ GPR119 Q8TDV5 8/20 0.37
▸ AKR1C3 P42330 1/20 0.36
▸ MAPT P10636 2/20 0.34
▸ GAA P10253 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ CSF1R P07333 2/20 0.34
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ PLK4 O00444 1/20 0.33
▸ RAD52 P43351 1/20 0.33

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
SCHEMBL21274042 1.00 HSD11B1 (0.41) HSD11B1GPR119AKR1C3MAPTGAA
SCHEMBL21268745 0.90 HSD11B1 (0.39) HSD11B1GPR119AKR1C3MAPTGAA
SCHEMBL21268748 0.90 HSD11B1 (0.39) HSD11B1GPR119AKR1C3MAPTGAA
SCHEMBL21268712 0.90 HSD11B1 (0.39) HSD11B1GPR119AKR1C3CSF1RMEN1
SCHEMBL21268711 0.90 HSD11B1 (0.39) HSD11B1GPR119AKR1C3CSF1RMEN1
SCHEMBL21274390 0.87 AKR1C3 (0.46) HSD11B1GPR119AKR1C3MAPTKMT2A
SCHEMBL21274389 0.87 AKR1C3 (0.46) HSD11B1GPR119AKR1C3MAPTKMT2A
SCHEMBL21274383 0.86 GPR119 (0.40) HSD11B1GPR119AKR1C3
SCHEMBL21274380 0.86 GPR119 (0.40) HSD11B1GPR119AKR1C3
SCHEMBL21268723 0.85 GPR119 (0.39) HSD11B1GPR119AKR1C3

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 9 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
EP-3752150-A1 PHARMACEUTICAL 6,5 HETEROBICYCLIC RING DERIVATIVES UCB Biopharma SRL (BE) 2020-12-23 — — EP 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
WO-2019158731-A1 PHARMACEUTICAL 6,5 HETEROBICYCLIC RING DERIVATIVES UCB BIOPHARMA SPRL (BE) 2019-08-22 — — WO claimed
US-20200399268-A1 Pharmaceutical 6,5 Heterobicyclic Ring Derivatives EVOTEC (UK) LTD (GB) 2020-12-24 — — US disclosed
US-20200399268-A1 Pharmaceutical 6,5 Heterobicyclic Ring Derivatives EVOTEC (UK) LTD (GB) 2020-12-24 — — US disclosed
EP-3752150-A1 PHARMACEUTICAL 6,5 HETEROBICYCLIC RING DERIVATIVES UCB Biopharma SRL (BE) 2020-12-23 — — EP 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
WO-2019158731-A1 PHARMACEUTICAL 6,5 HETEROBICYCLIC RING DERIVATIVES UCB BIOPHARMA SPRL (BE) 2019-08-22 — — 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 (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 HSD11B1 1156/4885GPR119 388/4885AKR1C3 4226/4885

“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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