SCHEMBL29787141

SCHEMBL29787141

CCSc1cc(Br)cnc1Br

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.42
KMT2A Q03164 1/20 0.42
AOC3 Q16853 1/20 0.36
SMN1; SMN2 Q16637 3/20 0.35
MAPT P10636 1/20 0.35
DYRK1A Q13627 1/20 0.33
GBA1 P04062 1/20 0.32
ALDH1A1 P00352 2/20 0.31
HSD17B10 Q99714 1/20 0.31
PKM P14618 1/20 0.30

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
SCHEMBL20819261 1.00 HTT (0.42) HTTKMT2AAOC3SMN1; SMN2MAPT
SCHEMBL17504792 0.82 SMN1; SMN2 (0.39) HTTKMT2AAOC3SMN1; SMN2MAPT
SCHEMBL24300300 0.82 HTT (0.36) HTTKMT2AAOC3SMN1; SMN2MAPT
SCHEMBL30630201 0.82 HTT (0.36) HTTKMT2AAOC3SMN1; SMN2MAPT
SCHEMBL21830937 0.81 AOC3 (0.34) HTTAOC3SMN1; SMN2ALDH1A1
SCHEMBL21538379 0.81 HTT (0.35) HTTKMT2AAOC3SMN1; SMN2MAPT
SCHEMBL30110292 0.81 HTT (0.35) HTTKMT2AAOC3SMN1; SMN2MAPT
SCHEMBL30989644 0.78 HTT (0.33) HTTKMT2AAOC3SMN1; SMN2MAPT
SCHEMBL29257094 0.78 HTT (0.33) HTTKMT2AAOC3SMN1; SMN2MAPT
SCHEMBL18845126 0.77 HTT (0.41) HTTKMT2ASMN1; SMN2MAPTDYRK1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113811532-B Pesticidally active heterocyclic derivatives with sulfur containing substituents 先正达农作物保护股份公司 2025-04-11 CN disclosed
CN-119431377-A Pesticidally active heterocyclic derivatives with sulfoximine containing substituents 先正达农作物保护股份公司 2025-02-14 CN disclosed
CN-118355004-A Cyclopropyl- (heteroaryl) -substituted ethylsulfonyl-pyridine derivatives 勃林格殷格翰动物保健有限公司 2024-07-16 CN disclosed
EP-4305042-A1 TRICYCLIC PESTICIDAL COMPOUNDS BASF SE (DE) 2024-01-17 EP disclosed
CN-116964062-A Pesticidal tricyclic compounds 巴斯夫欧洲公司 2023-10-27 CN disclosed
CN-111108107-B Pesticidally active heterocyclic derivatives with sulfur containing substituents 先正达参股股份有限公司 2023-09-29 CN disclosed
EP-4107159-A1 5-(3-(ETHYLSULFONYL)PYRIDIN-2-YL)-PYRAZOLO[1,5-A]PYRIMIDINE DERIVATIVES AND RELATED COMPOUNDS AS PESTICIDE AND INSECTICIDE AGENTS FOR CROP PROTECTION PI Industries Ltd. (IN) 2022-12-28 EP disclosed
CN-115427411-A 5- (3- (ethylsulfonyl) pyridin-2-yl) -pyrazolo [1,5-a ] pyrimidine derivatives and related compounds as pesticides for crop protection PI工业有限公司 2022-12-02 CN disclosed
WO-2022189191-A1 TRICYCLIC PESTICIDAL COMPOUNDS BASF SE (DE) 2022-09-15 WO disclosed
US-11413291-B2 Pesticidally active heterocyclic derivatives with sulfur containing substituents SYNGENTA PARTICIPATIONS AG (CH) 2022-08-16 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-11413291-B2 Pesticidally active heterocyclic derivatives with sulfur containing substituents DDT, ACHE, SQOR HTT 923/4885KMT2A 3351/4885AOC3 312/4885

“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.