SCHEMBL30130355

SCHEMBL30130355

COC(=O)[C@@H]1C[C@@H]1COS(=O)(=O)c1ccc(C)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
STAT3 P40763 2/20 0.43
MMP2 P08253 5/20 0.42
ANPEP P15144 1/20 0.42
CA1 P00915 3/20 0.42
CA2 P00918 3/20 0.42
CA4 P22748 1/20 0.42
CA7 P43166 1/20 0.42
KMT2A Q03164 4/20 0.41
ALDH1A1 P00352 3/20 0.41
CYP3A4 P08684 7/20 0.41
MEN1 O00255 3/20 0.41
CYP1A2 P05177 4/20 0.39
CYP2C9 P11712 4/20 0.39
CYP2C19 P33261 4/20 0.39
TSHR P16473 3/20 0.39
LMNA P02545 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
CTDSP1 Q9GZU7 1/20 0.39
SIRT5 Q9NXA8 1/20 0.39
MAPT P10636 1/20 0.39

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
SCHEMBL30636832 1.00 STAT3 (0.43) STAT3MMP2ANPEPCA1CA2
SCHEMBL20559391 0.88 ALDH1A1 (0.48) CA1CA2KMT2AALDH1A1MEN1
SCHEMBL4970833 0.88 ALDH1A1 (0.48) CA1CA2KMT2AALDH1A1MEN1
SCHEMBL28904679 0.86 CA1 (0.47) STAT3CA1CA2KMT2AALDH1A1
SCHEMBL21822929 0.81 STAT3 (0.43) STAT3MMP2ANPEPKMT2AALDH1A1
SCHEMBL26919725 0.78 STAT3 (0.42) STAT3MMP2CA1CA2CA7
SCHEMBL17341143 0.77 STAT3 (0.41) STAT3MMP2ANPEPKMT2AALDH1A1
SCHEMBL1482389 0.77 ALDH1A1 (0.49) STAT3KMT2AALDH1A1MEN1CYP2C9
SCHEMBL21987511 0.77 ALDH1A1 (0.49) STAT3KMT2AALDH1A1MEN1CYP2C9
SCHEMBL8258339 0.77 ALDH1A1 (0.49) STAT3KMT2AALDH1A1MEN1CYP2C9

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-11529341-B2 Bicyclic compounds as inhibitors of PD1/PD-L1 interaction/activation Jubilant Prodel LLC 2022-12-20 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-11529341-B2 Bicyclic compounds as inhibitors of PD1/PD-L1 interaction/activation CD274, PDCD1, PDCD1LG2 STAT3 1058/4885MMP2 2256/4885ANPEP 3166/4885

“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.