SCHEMBL3129943

SCHEMBL3129943

O=S(=O)(Cl)c1cccc2ccncc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNF P01375 2/20 0.46
CYP3A4 P08684 5/20 0.42
PRKD3 O94806 4/20 0.42
PRKCG P05129 4/20 0.42
PRKCB P05771 4/20 0.42
PRKCA P17252 4/20 0.42
PRKCH P24723 4/20 0.42
PRKCI P41743 4/20 0.42
PRKCE Q02156 4/20 0.42
PRKCQ Q04759 4/20 0.42
PRKCZ Q05513 4/20 0.42
PRKCD Q05655 4/20 0.42
PRKD1 Q15139 4/20 0.42
CYP2D6 P10635 4/20 0.42
MEN1 O00255 3/20 0.42
PRKACA P17612 3/20 0.42
PRKACG P22612 3/20 0.42
PRKACB P22694 3/20 0.42
KMT2A Q03164 3/20 0.42
NFKB1 P19838 2/20 0.42

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
SCHEMBL30002842 1.00 TNF (0.46) TNFCYP3A4PRKD3PRKCGPRKCB
SCHEMBL29546384 0.86 CYP3A4 (0.56) CYP3A4PRKD3PRKCGPRKCBPRKCA
SCHEMBL115053 0.86 CYP3A4 (0.56) CYP3A4PRKD3PRKCGPRKCBPRKCA
Hydrochloric Acid SCHEMBL987360 0.84 LMNA (0.57) CYP3A4PRKD3PRKCGPRKCBPRKCA
Hydrochloric Acid SCHEMBL29469852 0.84 LMNA (0.57) CYP3A4PRKD3PRKCGPRKCBPRKCA
SCHEMBL11983469 0.82 TNF (0.46) TNFCYP3A4PRKD3PRKCGPRKCB
SCHEMBL18019196 0.82 CA2 (0.61) TNFCYP3A4PRKD3PRKCGPRKCB
SCHEMBL26422606 0.82 TNF (0.46) TNFCYP3A4PRKD3PRKCGPRKCB
Hydrochloric Acid SCHEMBL27788261 0.81 TNF (0.45) TNFCYP3A4PRKD3PRKCGPRKCB
SCHEMBL28397978 0.78 TNF (0.42) TNFCYP3A4PRKD3PRKCGPRKCB

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 70 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260062393-A1 Compounds CTXT PTY LTD (AU) 2026-03-05 US disclosed
US-12365655-B2 Compounds CTXT PTY LTD (AU) 2025-07-22 US disclosed
CN-112334466-B Compounds of formula (I) CTXT私人有限公司 2025-05-30 CN disclosed
CN-115232144-B Nitrogen-containing condensed ring derivative, pharmaceutical composition, and preparation method and application thereof 长春金赛药业有限责任公司 2024-04-02 CN disclosed
EP-4335439-A2 COMPOUNDS CTXT PTY LTD (AU) 2024-03-13 EP disclosed
EP-3810602-B1 COMPOUNDS CTXT PTY LTD (AU) 2023-11-01 EP disclosed
EP-3810602-B1 COMPOUNDS CTXT PTY LTD (AU) 2023-11-01 EP disclosed
CN-115232144-A Nitrogen-containing fused ring derivative, pharmaceutical composition, preparation method and application thereof 长春金赛药业有限责任公司 2022-10-25 CN disclosed
US-20220153710-A1 Compounds CTXT PTY LTD (AU) 2022-05-19 US disclosed
US-20220153710-A1 Compounds CTXT PTY LTD (AU) 2022-05-19 US disclosed
WO-2007098418-A1 COMPOUNDS HAVING 5-HT6 RECEPTOR AFFINITY MEMORY PHARMACEUTICALS CORPORATION (US) 2007-08-30 WO disclosed
EP-1467727-A1 1,3-DISUBSTITUTED AND 1,3,3,-TRISUBSTITUTED PYRROLIDINES AS HISTAMINE-3 RECEPTOR LIGANDS AND THEIR THERAPEUTIC APPLICATIONS Abbott Laboratories (US) 2004-10-20 EP disclosed
US-6620839-B2 1,3-disubstituted and 1,3,3-trisubstituted pyrrolidines as histamine-3 receptor ligands and their therapeutic applications ABBOTT LABORATORIES 2003-09-16 US disclosed
WO-2003059341-A1 1,3-DISUBSTITUTED AND 1,3,3,-TRISUBSTITUTED PYRROLIDINES AS HISTAMINE-3 RECEPTOR LIGANDS AND THEIR THERAPEUTIC APPLICATIONS ABBOTT LABORATORIES (US) 2003-07-24 WO disclosed
EP-1301480-A1 1,3-DISUBSTITUTED AND 1,3,3-TRISUBSTITUTED PYRROLIDINES AS HISTAMINE-3 RECEPTOR LIGANDS AND THEIR THERAPEUTIC APPLICATIONS ABBOTT LABORATORIES (US) 2003-04-16 EP disclosed
US-6515013-B2 For diseases or conditions caused by or exacerbated by histamine-3 receptor activity ABBOTT LABORATORIES 2003-02-04 US disclosed
US-20020137931-A1 1,3-disubstituted and 1,3,3-trisubstituted pyrrolidines as histamine-3 receptor ligands and their therapeutic applications ABBVIE INC. 2002-09-26 US disclosed
US-20020035103-A1 1,3-Disubstituted and 1,3,3-trisubstituted pyrrolidines as histamine-3 receptor ligands and their therapeutic applications ABBVIE INC. 2002-03-21 US disclosed
WO-2002006223-A1 1,3-DISUBSTITUTED AND 1,3,3-TRISUBSTITUTED PYRROLIDINES AS HISTAMINE-3 RECEPTOR LIGANDS AND THEIR THERAPEUTIC APPLICATIONS ABBOTT LABORATORIES (US) 2002-01-24 WO disclosed
US-4857301-A ANTIALLERGENS SCHERING CORPORATION (US) 1989-08-15 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 (5 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-20020137931-A1 1,3-disubstituted and 1,3,3-trisubstituted pyrrolidines as histamine-3 receptor ligands and their therapeutic applications HRH3, HRH4, HRH1 TNF 4084/4885CYP3A4 2475/4885PRKD3 782/4885
US-20020035103-A1 1,3-Disubstituted and 1,3,3-trisubstituted pyrrolidines as histamine-3 receptor ligands and their therapeutic applications HRH3, HRH4, HRH1 TNF 4084/4885CYP3A4 2475/4885PRKD3 782/4885
US-20220153710-A1 Compounds SLC10A1, ABCB11, PCSK9 TNF 2917/4885CYP3A4 50/4885PRKD3 4201/4885
US-20260062393-A1 Compounds SCN2B, ABCB11, SCN1B TNF 4696/4885CYP3A4 329/4885PRKD3 2321/4885
US-12365655-B2 Compounds SLC10A1, ABCB11, PCSK9 TNF 2915/4885CYP3A4 50/4885PRKD3 4200/4885

“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.