SCHEMBL25519976

SCHEMBL25519976

Cc1ccc(Br)c(S(=O)(=O)C2COC2)c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.35
HTR2C P28335 1/20 0.35
HTR2B P41595 1/20 0.35
EDNRB P24530 2/20 0.33
EDNRA P25101 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
LMNA P02545 1/20 0.33
GAA P10253 2/20 0.33
USP2 O75604 1/20 0.33
KMT2A Q03164 1/20 0.33
ALDH1A1 P00352 2/20 0.32
TSHR P16473 2/20 0.32
MAPK1 P28482 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HTT P42858 1/20 0.32
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
TP53 P04637 2/20 0.32

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
SCHEMBL25519678 0.85 L3MBTL1 (0.39) HTR2AHTR2CHTR2BL3MBTL1GAA
SCHEMBL25519971 0.83 ALDH1A1 (0.43) EDNRBEDNRAL3MBTL1LMNAGAA
SCHEMBL28999336 0.74 CA2 (0.41) EDNRBEDNRAL3MBTL1LMNAALDH1A1
SCHEMBL16903640 0.74 HCRTR1 (0.34) L3MBTL1GAAKMT2ATSHRMAPK1
SCHEMBL28956369 0.73 CNR2 (0.33) EDNRBEDNRAALDH1A1CA12CA1
SCHEMBL12705613 0.72 GAA (0.46) GAAKMT2AALDH1A1TSHRSMN1; SMN2
SCHEMBL25529192 0.71 CA12 (0.41) CA12CA1CA9
SCHEMBL5174336 0.71 L3MBTL1 (0.39) EDNRBEDNRAL3MBTL1LMNAGAA
SCHEMBL29973654 0.70 PIK3CA (0.35)
SCHEMBL25520188 0.70 PIK3CA (0.35)

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-20230142274-A1 SUBSTITUTED ARYL COMPOUND NANJING ZAIMING PHARMACEUTICAL CO., LTD. (CN) 2023-05-11 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-20230142274-A1 SUBSTITUTED ARYL COMPOUND RAD51, FANCI, BLM HTR2A 842/4885HTR2C 933/4885HTR2B 1042/4885

“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.