SCHEMBL21274104

SCHEMBL21274104

CC(C)[Si](C(C)C)(C(C)C)n1cc(Br)c2ccc(N3CCN(C(=O)OC(C)(C)C)CC3)nc21

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MAP4K4 O95819 1/20 0.46
▸ CKS1B P61024 2/20 0.43
▸ SKP1 P63208 2/20 0.43
▸ SKP2 Q13309 2/20 0.43
▸ RET P07949 2/20 0.42
▸ SUV39H2 Q9H5I1 2/20 0.40
▸ HTT P42858 1/20 0.39
▸ ATM Q13315 1/20 0.39
▸ GPR119 Q8TDV5 5/20 0.39
▸ GBA1 P04062 2/20 0.38
▸ KCNH2 Q12809 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ PRMT5 O14744 1/20 0.38
▸ BACE1 P56817 1/20 0.37
▸ DDB1 Q16531 1/20 0.37
▸ CRBN Q96SW2 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
SCHEMBL22801977 0.81 MAP4K4 (0.49) MAP4K4CKS1BSKP1SKP2SUV39H2
SCHEMBL22801955 0.76 HTR3E (0.39) HTTALDH1A1
SCHEMBL29435004 0.75 MAP4K4 (0.56) MAP4K4CKS1BSKP1SKP2RET
SCHEMBL22118550 0.75 MAP4K4 (0.56) MAP4K4CKS1BSKP1SKP2RET
SCHEMBL12701300 0.75 MAP4K4 (0.53) MAP4K4CKS1BSKP1SKP2RET
SCHEMBL30993610 0.75 MAP4K4 (0.53) MAP4K4CKS1BSKP1SKP2RET
SCHEMBL12127981 0.74 SCN9A (0.44) HTTGPR119ALDH1A1MAPT
SCHEMBL15173541 0.74 MAP4K4 (0.64) MAP4K4CKS1BSKP1SKP2RET
SCHEMBL27027530 0.74 MAP4K4 (0.55) MAP4K4CKS1BSKP1SKP2RET
SCHEMBL25248226 0.73 MAP4K4 (0.52) MAP4K4CKS1BSKP1SKP2RET

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 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 MAP4K4 4538/4885CKS1B 2847/4885SKP1 4279/4885

“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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