SCHEMBL14301679

SCHEMBL14301679

C=C[C@@H]1C[C@]1(CC)C(=O)NS(=O)(=O)c1cccc(OCc2ccccc2)c1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.44
▸ BCL2L1 Q07817 6/20 0.43
▸ MCL1 Q07820 5/20 0.43
▸ ADAM17 P78536 3/20 0.42
▸ LMNA P02545 1/20 0.42
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ FAAH O00519 1/20 0.41
▸ CNR2 P34972 1/20 0.41
▸ MAOB P27338 1/20 0.39
▸ PTPN1 P18031 1/20 0.39
▸ PPARG P37231 2/20 0.39
▸ NR4A2 P43354 1/20 0.38
▸ KAT6A Q92794 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
SCHEMBL14277999 0.87 POLB (0.46) POLBBCL2L1MCL1ADAM17LMNA
SCHEMBL1015026 0.85 BCL2L1 (0.44) POLBBCL2L1MCL1ADAM17LMNA
SCHEMBL1015028 0.85 BCL2L1 (0.44) POLBBCL2L1MCL1ADAM17LMNA
SCHEMBL14364377 0.84 POLB (0.43) POLBBCL2L1MCL1ADAM17LMNA
SCHEMBL14364344 0.84 POLB (0.43) POLBBCL2L1MCL1ADAM17LMNA
Hydrochloric Acid SCHEMBL5112794 0.84 BCL2L1 (0.43) POLBBCL2L1MCL1ADAM17LMNA
Hydrochloric Acid SCHEMBL5106017 0.84 BCL2L1 (0.43) POLBBCL2L1MCL1ADAM17LMNA
SCHEMBL5570893 0.83 BCL2L1 (0.43) POLBBCL2L1MCL1ADAM17LMNA
SCHEMBL5108395 0.83 ADAM17 (0.45) POLBBCL2L1MCL1ADAM17LMNA
Hydrochloric Acid SCHEMBL5106015 0.83 ADAM17 (0.44) POLBBCL2L1MCL1ADAM17LMNA

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-20080045530-A1 Organic Compounds and Their Uses BRANDL TRIXI 2008-02-21 — — 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-20080045530-A1 Organic Compounds and Their Uses OAT, OTC, AOX1 POLB 419/4885BCL2L1 2218/4885MCL1 1531/4885

“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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