SCHEMBL26053285

SCHEMBL26053285

CC(=O)N1CC[C@@](C)(C(F)F)C1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.38
CYP3A4 P08684 4/20 0.36
CYP2C19 P33261 3/20 0.36
ALDH1A1 P00352 2/20 0.36
MAPK1 P28482 1/20 0.36
CYP1A2 P05177 3/20 0.34
TDP1 Q9NUW8 1/20 0.34
CYP2C9 P11712 3/20 0.34
CYP2D6 P10635 3/20 0.34
USP2 O75604 3/20 0.33
TSHR P16473 2/20 0.33
EPHX2 P34913 2/20 0.33
OPRM1 P35372 1/20 0.33
OPRL1 P41146 1/20 0.33
HPGD P15428 1/20 0.33
CYP4F2 P78329 1/20 0.33
CYP4A11 Q02928 1/20 0.33
HIF1A Q16665 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 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
SCHEMBL25708741 1.00 SMN1; SMN2 (0.38) SMN1; SMN2CYP3A4CYP2C19ALDH1A1MAPK1
SCHEMBL8380431 0.88 CYP1A2 (0.41) SMN1; SMN2CYP3A4CYP2C19ALDH1A1MAPK1
SCHEMBL24317731 0.82 SMN1; SMN2 (0.39) SMN1; SMN2CYP3A4CYP2C19ALDH1A1MAPK1
SCHEMBL12921202 0.82 SMN1; SMN2 (0.39) SMN1; SMN2CYP3A4CYP2C19ALDH1A1MAPK1
SCHEMBL17172988 0.82 SMN1; SMN2 (0.39) SMN1; SMN2CYP3A4CYP2C19ALDH1A1MAPK1
SCHEMBL26634748 0.78 SMN1; SMN2 (0.36) SMN1; SMN2CYP3A4CYP2C19ALDH1A1MAPK1
SCHEMBL4815629 0.74 SMN1; SMN2 (0.46) SMN1; SMN2CYP3A4CYP2C19ALDH1A1MAPK1
SCHEMBL4815638 0.74 SMN1; SMN2 (0.46) SMN1; SMN2CYP3A4CYP2C19ALDH1A1MAPK1
SCHEMBL14995989 0.74 SPR (0.45) SMN1; SMN2CYP3A4CYP2C19ALDH1A1MAPK1
SCHEMBL7897247 0.74 PIK3CD (0.44) SMN1; SMN2CYP3A4CYP2C19ALDH1A1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230265090-A1 QUINAZOLINE COMPOUND MEDSHINE DISCOVERY INC. (CN) 2023-08-24 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 (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-20230265090-A1 QUINAZOLINE COMPOUND ABCG2, CYP3A7, ABL1 SMN1; SMN2 2114/4885CYP3A4 31/4885CYP2C19 5/4885

“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.