SCHEMBL17634298

SCHEMBL17634298

CC(C)(C)OC(=O)N1CCN(c2ccc(Br)c3cn[nH]c23)CC1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CKS1B P61024 2/20 0.45
▸ SKP1 P63208 2/20 0.45
▸ SKP2 Q13309 2/20 0.45
▸ GPR119 Q8TDV5 4/20 0.43
▸ KIT P10721 2/20 0.43
▸ BACE1 P56817 2/20 0.43
▸ CHRM2 P08172 1/20 0.42
▸ CHRM4 P08173 1/20 0.42
▸ CHRM1 P11229 1/20 0.42
▸ CHRM3 P20309 1/20 0.42
▸ MAPT P10636 2/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ TSHR P16473 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ ACACB O00763 2/20 0.42
▸ GBA1 P04062 1/20 0.42
▸ KCNH2 Q12809 1/20 0.42

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
SCHEMBL25337613 0.81 BACE1 (0.44) CKS1BSKP1SKP2GPR119KIT
SCHEMBL3721916 0.79 PIK3CD (0.56) CKS1BSKP1SKP2GPR119KIT
SCHEMBL5372388 0.78 BACE1 (0.54) CKS1BSKP1SKP2GPR119BACE1
SCHEMBL29707379 0.78 BACE1 (0.54) CKS1BSKP1SKP2GPR119BACE1
SCHEMBL19297108 0.78 GPR119 (0.49) CKS1BSKP1SKP2GPR119KIT
SCHEMBL28587642 0.78 POLB (0.44) KMT2ASMN1; SMN2LMNA
SCHEMBL5068821 0.77 KIT (0.51) CKS1BSKP1SKP2GPR119KIT
SCHEMBL30485702 0.77 IDO1 (0.57) CKS1BSKP1SKP2GPR119KIT
SCHEMBL25366812 0.77 IDO1 (0.57) CKS1BSKP1SKP2GPR119KIT
SCHEMBL3673763 0.77 TRPV1 (0.53) CKS1BSKP1SKP2GPR119KIT

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
EP-3197870-B1 INHIBITORS OF KRAS G12C MUTANT PROTEINS ARAXES PHARMA LLC (US) 2020-08-19 — — EP disclosed
EP-3197870-B1 INHIBITORS OF KRAS G12C MUTANT PROTEINS ARAXES PHARMA LLC (US) 2020-08-19 — — EP disclosed
US-20180141927-A1 INHIBITORS OF KRAS G12C MUTANT PROTEINS ARAXES PHARMA LLC 2018-05-24 — — US disclosed
EP-3197870-A1 INHIBITORS OF KRAS G12C MUTANT PROTEINS Araxes Pharma LLC (US) 2017-08-02 — — EP disclosed
US-20160108019-A1 INHIBITORS OF KRAS G12C MUTANT PROTEINS ARAXES PHARMA LLC 2016-04-21 — — US disclosed
WO-2016049524-A1 INHIBITORS OF KRAS G12C MUTANT PROTEINS ARAXES PHARMA LLC (US) 2016-03-31 — — WO disclosed
WO-2016049524-A1 INHIBITORS OF KRAS G12C MUTANT PROTEINS ARAXES PHARMA LLC (US) 2016-03-31 — — 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-20160108019-A1 INHIBITORS OF KRAS G12C MUTANT PROTEINS KRAS, NRAS, HRAS CKS1B 146/4885SKP1 206/4885SKP2 119/4885
US-20180141927-A1 INHIBITORS OF KRAS G12C MUTANT PROTEINS KRAS, NRAS, HRAS CKS1B 146/4885SKP1 206/4885SKP2 119/4885

“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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