SCHEMBL16117707

SCHEMBL16117707

C=CS(=O)(=O)NC1CCN(C(=O)CNc2cccc3nsnc23)CC1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 4/20 0.44
▸ CYP3A4 P08684 3/20 0.44
▸ CYP2C19 P33261 3/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ ALOX15 P16050 1/20 0.39
▸ CCKBR P32239 1/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ GAA P10253 1/20 0.38
▸ ALDH1A1 P00352 3/20 0.38
▸ LMNA P02545 2/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ CHRM1 P11229 1/20 0.38
▸ MAPT P10636 2/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ HPGD P15428 1/20 0.38

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
SCHEMBL16117720 0.85 KRAS (0.36) SMN1; SMN2CYP3A4CYP2C19MAPK1CCKBR
SCHEMBL16117708 0.83 CCNK (0.37) SMN1; SMN2CYP3A4CYP2C19MAPK1CCKBR
SCHEMBL16117709 0.81 KRAS (0.48) SMN1; SMN2MAPK1KMT2AGAAALDH1A1
SCHEMBL15337772 0.79 KRAS (0.34) SMN1; SMN2CYP3A4CYP2C19MAPK1CCKBR
SCHEMBL17813648 0.78 CA12 (0.34) —
SCHEMBL20260187 0.77 AKR1C3 (0.35) —
SCHEMBL16117728 0.77 BTK (0.34) SMN1; SMN2CYP3A4CYP2C19MAPK1KMT2A
SCHEMBL15337774 0.74 KRAS (0.58) GAA
SCHEMBL16117764 0.74 KRAS (0.47) —
SCHEMBL16117768 0.74 CCR8 (0.42) —

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
US-10919850-B2 Covalent inhibitors of KRas G12C ARAXES PHARMA LLC (US) 2021-02-16 — — US disclosed
US-10273207-B2 Covalent inhibitors of kras G12C ARAXES PHARMA LLC (US) 2019-04-30 — — US disclosed
US-20180162812-A1 COVALENT INHIBITORS OF KRAS G12C ARAXES PHARMA LLC 2018-06-14 — — US disclosed
US-9926267-B2 Covalent inhibitors of K-Ras G12C ARAXES PHARMA LLC (US) 2018-03-27 — — US disclosed
US-20160159738-A1 COVALENT INHIBITORS OF KRAS G12C ARAXES PHARMA LLC 2016-06-09 — — US disclosed
US-9227978-B2 Covalent inhibitors of Kras G12C ARAXES PHARMA LLC (US) 2016-01-05 — — US disclosed
US-20140288045-A1 COVALENT INHIBITORS OF KRAS G12C ARAXES PHARMA LLC 2014-09-25 — — US 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 (5 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-20140288045-A1 COVALENT INHIBITORS OF KRAS G12C KRAS, NRAS, HRAS SMN1; SMN2 3761/4885CYP3A4 4548/4885CYP2C19 4459/4885
US-20160159738-A1 COVALENT INHIBITORS OF KRAS G12C KRAS, NRAS, HRAS SMN1; SMN2 3761/4885CYP3A4 4548/4885CYP2C19 4459/4885
US-20180162812-A1 COVALENT INHIBITORS OF KRAS G12C KRAS, NRAS, HRAS SMN1; SMN2 3761/4885CYP3A4 4548/4885CYP2C19 4459/4885
US-10919850-B2 Covalent inhibitors of KRas G12C KRAS, NRAS, HRAS SMN1; SMN2 3761/4885CYP3A4 4548/4885CYP2C19 4459/4885
US-10273207-B2 Covalent inhibitors of kras G12C KRAS, NRAS, HRAS SMN1; SMN2 3761/4885CYP3A4 4548/4885CYP2C19 4459/4885

“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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