SCHEMBL13950808

SCHEMBL13950808

Bc1ccc(NS(=O)(=O)c2ccc(C)cc2)c(C(=O)c2ccccc2)c1

nearest known ligand 0.74

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 4/20 0.74
▸ HTT P42858 2/20 0.74
▸ TP53 P04637 1/20 0.60
▸ MAPT P10636 1/20 0.60
▸ KMT2A Q03164 1/20 0.60
▸ ALDH1A1 P00352 4/20 0.59
▸ CYP1A2 P05177 2/20 0.59
▸ HPGD P15428 1/20 0.59
▸ HSD17B10 Q99714 1/20 0.59
▸ CCR9 P51686 2/20 0.58
▸ METAP2 P50579 3/20 0.57
▸ CYP2C9 P11712 1/20 0.55
▸ BDKRB1 P46663 3/20 0.54
▸ KEAP1 Q14145 1/20 0.51
▸ NFE2L2 Q16236 1/20 0.51
▸ MCL1 Q07820 1/20 0.50
▸ KCNA5 P22460 1/20 0.49

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
SCHEMBL12220857 0.90 LMNA (0.81) LMNAHTTTP53MAPTKMT2A
SCHEMBL14311492 0.87 CCR9 (0.61) LMNAHTTTP53MAPTKMT2A
SCHEMBL11182634 0.85 LMNA (1.00) LMNAHTTTP53MAPTKMT2A
SCHEMBL29148 0.85 METAP2 (0.75) LMNAHTTTP53MAPTKMT2A
SCHEMBL27995 0.84 ALDH1A1 (0.74) LMNAHTTMAPTKMT2AALDH1A1
SCHEMBL13484207 0.84 LMNA (0.72) LMNAHTTTP53MAPTKMT2A
SCHEMBL13137558 0.84 LMNA (0.80) LMNAHTTTP53MAPTKMT2A
SCHEMBL2534878 0.83 LMNA (0.86) LMNAHTTTP53MAPTKMT2A
SCHEMBL13483878 0.82 LMNA (0.70) LMNAHTTTP53MAPTKMT2A
SCHEMBL16479405 0.81 LMNA (0.71) LMNAHTTTP53MAPTKMT2A

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-20090054495-A1 CCR9 inhibitors and methods of use thereof MILLENNIUM PHARMACEUTICALS, INC. 2009-02-26 — — 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-20090054495-A1 CCR9 inhibitors and methods of use thereof CCR9, CCR1, CCR4 LMNA 3548/4885HTT 4358/4885TP53 3735/4885

“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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