SCHEMBL2362044

SCHEMBL2362044

Cn1ncc(C(=O)O)c1S(C)(=O)=O

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.37
ALDH1A1 P00352 3/20 0.36
LMNA P02545 2/20 0.36
MAPK1 P28482 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
NR4A3 Q92570 1/20 0.35
PTGS2 P35354 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
KMT2A Q03164 1/20 0.33
POLB P06746 2/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
MAPT P10636 1/20 0.32

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
SCHEMBL27551847 0.84 CA1 (0.36) KDM4EALDH1A1TDP1NR4A3KMT2A
SCHEMBL18209761 0.81 MCL1 (0.37) KDM4EALDH1A1LMNATDP1NR4A3
SCHEMBL18209696 0.81 KDM4E (0.34) KDM4EALDH1A1TDP1NR4A3SMN1; SMN2
SCHEMBL2360995 0.77 NPC1 (0.45) KDM4EALDH1A1LMNAMAPK1SMN1; SMN2
SCHEMBL10718645 0.76 NOTUM (0.41) LMNAMAPK1NR4A3SMN1; SMN2NPC1
SCHEMBL7722135 0.72 KDM4E (0.41) KDM4EALDH1A1TDP1NR4A3SMN1; SMN2
SCHEMBL966692 0.72 KDM4E (0.41) KDM4EALDH1A1TDP1NR4A3SMN1; SMN2
SCHEMBL1663553 0.72 SMN1; SMN2 (0.50) KDM4EALDH1A1LMNAMAPK1TDP1
SCHEMBL68535 0.72 PDE10A (0.41) KDM4EALDH1A1TDP1NR4A3SMN1; SMN2
SCHEMBL7023904 0.72 NR4A3 (0.30) NR4A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4739685-A1 1,6-NAPHTHRIDINE COMPOUNDS AS SMARCA2 INHIBITORS USEFUL FOR THE TREATMENT OF SMARCA4 DEFICIENT CANCERS Janssen Pharmaceutica NV (BE) 2026-05-13 EP disclosed
WO-2025008061-A1 1,6-NAPHTHRIDINE COMPOUNDS AS SMARCA2 INHIBITORS USEFUL FOR THE TREATMENT OF SMARCA4 DEFICIENT CANCERS JANSSEN PHARMACEUTICA NV (BE) 2025-01-09 WO disclosed
CN-102216285-B Tetrasubstituted pyridazine hedgehog pathway antagonists LILLY CO ELI 2014-08-13 CN disclosed
US-8507490-B2 Tetrasubstituted pyridazine hedgehog pathway antagonists ELI LILLY AND COMPANY (US) 2013-08-13 US disclosed
US-8507490-B2 Tetrasubstituted pyridazine hedgehog pathway antagonists ELI LILLY AND COMPANY (US) 2013-08-13 US disclosed
US-8507490-B2 Tetrasubstituted pyridazine hedgehog pathway antagonists ELI LILLY AND COMPANY (US) 2013-08-13 US disclosed
EP-2358698-B1 TETRASUBSTITUTED PYRIDAZINE AS HEDGEHOG PATHWAY ANTAGONISTS LILLY CO ELI (US) 2012-09-05 EP disclosed
US-20110263602-A1 TETRASUBSTITUTED PYRIDAZINE HEDGEHOG PATHWAY ANTAGONISTS ELI LILLY AND COMPANY (US) 2011-10-27 US disclosed
US-20110263602-A1 TETRASUBSTITUTED PYRIDAZINE HEDGEHOG PATHWAY ANTAGONISTS ELI LILLY AND COMPANY (US) 2011-10-27 US disclosed
US-20110263602-A1 TETRASUBSTITUTED PYRIDAZINE HEDGEHOG PATHWAY ANTAGONISTS ELI LILLY AND COMPANY (US) 2011-10-27 US disclosed
CN-102216285-A Tetrasubstituted pyridazine hedgehog pathway antagonists LILLY CO ELI 2011-10-12 CN disclosed
EP-2358698-A1 TETRASUBSTITUTED PYRIDAZINE HEDGEHOG PATHWAY ANTAGONISTS Eli Lilly and Company (US) 2011-08-24 EP disclosed
WO-2010056588-A1 TETRASUBSTITUTED PYRIDAZINE HEDGEHOG PATHWAY ANTAGONISTS ELI LILLY AND COMPANY (US) 2010-05-20 WO disclosed
WO-2010056588-A1 TETRASUBSTITUTED PYRIDAZINE HEDGEHOG PATHWAY ANTAGONISTS ELI LILLY AND COMPANY (US) 2010-05-20 WO 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-20110263602-A1 TETRASUBSTITUTED PYRIDAZINE HEDGEHOG PATHWAY ANTAGONISTS SHH, SMO, GLI1 KDM4E 702/4885ALDH1A1 4107/4885LMNA 4387/4885

“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.