SCHEMBL1104732

SCHEMBL1104732

CN1CCC[C@@H]1c1nnc(-c2cc(Cl)c(F)cc2NS(=O)(=O)c2ccc(C(C)(C)C)cc2)n1C

nearest known ligand 0.42

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BRPF1 P55201 1/20 0.42
HSD17B2 P37059 3/20 0.39
TP53 P04637 1/20 0.39
CCR9 P51686 15/20 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
SCHEMBL1093986 0.85 HSD17B2 (0.39) BRPF1HSD17B2CCR9
SCHEMBL1093989 0.85 HSD17B2 (0.39) BRPF1HSD17B2CCR9
SCHEMBL1095006 0.84 TP53 (0.43) HSD17B2TP53CCR9
SCHEMBL1094564 0.83 CCR9 (0.39) BRPF1HSD17B2CCR9
SCHEMBL1093993 0.83 TP53 (0.39) BRPF1HSD17B2TP53CCR9
SCHEMBL10168803 0.83 GFER (0.38) TP53
SCHEMBL1095017 0.83 TP53 (0.40) HSD17B2TP53CCR9
SCHEMBL1094209 0.82 HSD17B2 (0.47) HSD17B2CCR9
SCHEMBL1095189 0.80 CCR9 (0.41) BRPF1HSD17B2CCR9
SCHEMBL1094199 0.80 BRPF1 (0.43) BRPF1HSD17B2CCR9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8481579-B2 Triazolyl phenyl benzenesulfonamides CHEMOCENTRYX, INC. (US) 2013-07-09 US disclosed
US-20120165303-A1 TRIAZOLYL PHENYL BENZENESULFONAMIDES CHEMOCENTRYX, INC. (US) 2012-06-28 US disclosed
US-8153818-B2 Triazolyl phenyl benzenesulfonamides CHEMOCENTRYX, INC. (US) 2012-04-10 US disclosed
US-20100190762-A1 TRIAZOLYL PHENYL BENZENESULFONAMIDES CHEMOCENTRYX, INC. (US) 2010-07-29 US disclosed
US-7718683-B2 Triazolyl phenyl benzenesulfonamides CHEMOCENTRYX, INC. (US) 2010-05-18 US disclosed
US-20080039465-A1 TRIAZOLYL PHENYL BENZENESULFONAMIDES CHEMOCENTRYX, INC. 2008-02-14 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 (3 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-20120165303-A1 TRIAZOLYL PHENYL BENZENESULFONAMIDES CCR9, CCR2, CCR1 BRPF1 478/4885HSD17B2 3849/4885TP53 3275/4885
US-20100190762-A1 TRIAZOLYL PHENYL BENZENESULFONAMIDES CCR9, CCR2, CCR1 BRPF1 478/4885HSD17B2 3849/4885TP53 3275/4885
US-20080039465-A1 TRIAZOLYL PHENYL BENZENESULFONAMIDES CCR9, CCR2, CCR1 BRPF1 478/4885HSD17B2 3849/4885TP53 3275/4885

“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.