SCHEMBL3940478

SCHEMBL3940478

O=C(O)c1cccc(S(=O)(=O)NC2CC2)c1

nearest known ligand 0.76

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.76
ALDH1A1 P00352 2/20 0.76
KMT2A Q03164 3/20 0.66
CA1 P00915 1/20 0.59
CA2 P00918 1/20 0.59
CYP2C19 P33261 1/20 0.56
F2 P00734 2/20 0.55
PRSS1 P07477 2/20 0.55
PRSS2 P07478 2/20 0.55
PRSS3 P35030 2/20 0.55
MEP1B Q16820 2/20 0.54
AKR1C3 P42330 3/20 0.52
KDM4E B2RXH2 1/20 0.52
TSHR P16473 1/20 0.52
PTK2B Q14289 1/20 0.52
CSNK2A1 P68400 1/20 0.51
TDP1 Q9NUW8 1/20 0.50

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
SCHEMBL15575103 0.94 ALDH1A1 (0.75) LMNAALDH1A1KMT2ACA1CA2
SCHEMBL26144898 0.94 LMNA (0.71) LMNAALDH1A1KMT2ACA1CA2
SCHEMBL925723 0.93 ALDH1A1 (0.78) LMNAALDH1A1KMT2ACA1CA2
SCHEMBL17479215 0.93 ALDH1A1 (0.78) LMNAALDH1A1KMT2ACA1CA2
SCHEMBL26144904 0.88 ALDH1A1 (0.59) LMNAALDH1A1KMT2ACA1CA2
SCHEMBL16222311 0.88 ALDH1A1 (0.64) LMNAALDH1A1KMT2ACA1CA2
SCHEMBL26144953 0.88 ALDH1A1 (0.64) LMNAALDH1A1KMT2ACA1CA2
SCHEMBL26144935 0.87 ALDH1A1 (0.58) LMNAALDH1A1KMT2ACA1CA2
SCHEMBL26144907 0.87 ALDH1A1 (0.58) LMNAALDH1A1KMT2ACA1CA2
SCHEMBL2854062 0.86 ALDH1A1 (0.74) LMNAALDH1A1KMT2ACA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230147507-A1 INDOLINE COMPOUNDS FOR INHIBITING KIF18A VOLASTRA THERAPEUTICS, INC. (US) 2023-05-11 US disclosed
US-20230147507-A1 INDOLINE COMPOUNDS FOR INHIBITING KIF18A VOLASTRA THERAPEUTICS, INC. (US) 2023-05-11 US disclosed
CN-105985265-B Indenes -1- subunit sulfonyl benzoyl hydrazine derivatives and its preparation method and application 四川大学 2018-11-13 CN disclosed
CN-106146361-A Indenes-1-subunit sulfonyl benzoyl hydrazine derivant and its production and use 四川大学 2016-11-23 CN disclosed
CN-105985265-A Indene-1-subunit sulfonyl benzoyl hydrazine derivative as well as preparation method and application thereof 四川大学 2016-10-05 CN disclosed
WO-2016001452-A1 COMPOUNDS, IN PARTICULAR FOR USE IN THE TREATMENT OF A DISEASE OR CONDITION FOR WHICH A BROMODOMAIN INHIBITOR IS INDICATED Universität Zürich (CH) 2016-01-07 WO disclosed
WO-2016001452-A1 COMPOUNDS, IN PARTICULAR FOR USE IN THE TREATMENT OF A DISEASE OR CONDITION FOR WHICH A BROMODOMAIN INHIBITOR IS INDICATED Universität Zürich (CH) 2016-01-07 WO disclosed
WO-2012171488-A1 COUMARIN DERIVATIVE, PHARMACEUTICAL COMPOSITION AND USE THEREOF Beijing Hanmi Pharmaceutical Co., Ltd. (CN) 2012-12-20 WO disclosed
CN-102827124-A Coumarins derivate and medicine composition thereof and application BEIJING HANMEI PHARMACEUTICAL CO LTD 2012-12-19 CN disclosed
US-20090118261-A1 QUINAZOLINONE DERIVATIVES AND THEIR USE AS B-RAF INHIBITORS ASTRAZENECA AB (SE) 2009-05-07 US disclosed
EP-1831198-B1 PYRIDINE CARBOXAMIDE DERIVATIVES FOR USE AS ANTICANCER AGENTS ASTRAZENECA AB (SE) 2009-04-08 EP disclosed
US-20080275022-A1 Substituted Quinazolones as Anti-Cancer Agents ASTRAZENECA AB (SE) 2008-11-06 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-20090118261-A1 QUINAZOLINONE DERIVATIVES AND THEIR USE AS B-RAF INHIBITORS BRAF, RAF1, ARAF LMNA 2447/4885ALDH1A1 629/4885KMT2A 2503/4885
US-20080275022-A1 Substituted Quinazolones as Anti-Cancer Agents BRAF, NRAS, RAF1 LMNA 3372/4885ALDH1A1 619/4885KMT2A 2857/4885
US-20230147507-A1 INDOLINE COMPOUNDS FOR INHIBITING KIF18A KIF18A, KIF18B, KIF2C LMNA 2893/4885ALDH1A1 2609/4885KMT2A 339/4885

“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.