SCHEMBL20111913

SCHEMBL20111913

CC(C)N1CC(S(=O)(=O)N2CCN(C)CC2)C1

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.34
LMNA P02545 1/20 0.34
GAA P10253 1/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
NPSR1 Q6W5P4 1/20 0.33
ATM Q13315 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.32
USP2 O75604 1/20 0.32
ALDH1A1 P00352 2/20 0.31
CHRM2 P08172 1/20 0.31
CHRM1 P11229 1/20 0.31
TSHR P16473 1/20 0.31
APOBEC3A P31941 2/20 0.30
APOBEC3G Q9HC16 2/20 0.30
HTT P42858 2/20 0.30
MAPT P10636 1/20 0.30

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
SCHEMBL20111632 0.87 JAK2 (0.32) POLBLMNAGAAMEN1KMT2A
SCHEMBL20111636 0.79 MCOLN3 (0.41) POLBLMNAMEN1KMT2AL3MBTL1
SCHEMBL20111909 0.75 SMYD3 (0.30)
SCHEMBL21732885 0.75 CYP2D6 (0.47)
SCHEMBL10192196 0.74 POLB (0.41) POLBLMNAMEN1KMT2AL3MBTL1
SCHEMBL14883722 0.74 LMNA (0.44) LMNAGAAALDH1A1MAPT
SCHEMBL20111953 0.73 SMYD3 (0.40) POLBLMNAMEN1KMT2AL3MBTL1
SCHEMBL12026407 0.70
SCHEMBL13841320 0.69 APOBEC3A (0.46) POLBLMNAMEN1KMT2AL3MBTL1
SCHEMBL24870380 0.69 EPHX2 (0.36)

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230128824-A1 SPIRO RING-CONTAINING QUINAZOLINE COMPOUND Wigen Biomedicine Technology (shanghai) Co., Ltd. (CN) 2023-04-27 US disclosed
WO-2018078360-A1 MODULATORS OF HEDGEHOG (HH) SIGNALLING PATHWAY E-THERAPEUTICS PLC (GB) 2018-05-03 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-20230128824-A1 SPIRO RING-CONTAINING QUINAZOLINE COMPOUND KRAS, NRAS, HRAS POLB 4130/4885LMNA 2194/4885GAA 1955/4885

“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.