SCHEMBL5044902

SCHEMBL5044902

O=S(=O)(Nc1cc[c]cc1)c1cccc(Br)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGR P06401 4/20 0.61
BRD4 O60885 1/20 0.59
HSD17B2 P37059 1/20 0.56
PKM P14618 1/20 0.55
MAP4K4 O95819 1/20 0.50
PAK4 O96013 1/20 0.50
PIM1 P11309 1/20 0.50
LTK P29376 1/20 0.50
KDR P35968 1/20 0.50
MAPK14 Q16539 1/20 0.50
LRRK2 Q5S007 1/20 0.50
AURKB Q96GD4 1/20 0.50
ALK Q9UM73 1/20 0.50
PTPN2 P17706 1/20 0.50
PTPN1 P18031 1/20 0.50
PTPN5 P54829 1/20 0.50
WDR5 P61964 1/20 0.49
MEN1 O00255 1/20 0.49
ADORA3 P0DMS8 1/20 0.49
SLC6A3 Q01959 1/20 0.49

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
SCHEMBL30565215 0.85 PGR (0.75) PGRBRD4HSD17B2PKMMAP4K4
SCHEMBL1403074 0.85 PGR (0.75) PGRBRD4HSD17B2PKMMAP4K4
SCHEMBL5042029 0.83 PGR (0.53) PGRBRD4HSD17B2PKMMAP4K4
SCHEMBL14433749 0.83 HSD17B2 (0.66) PGRBRD4HSD17B2PKMMAP4K4
SCHEMBL1489068 0.81 PGR (0.65) PGRBRD4HSD17B2PKMMAP4K4
SCHEMBL22441735 0.81 PGR (0.72) PGRBRD4HSD17B2PKMKDR
SCHEMBL5046668 0.81 PGR (0.73) PGRPKMHDAC2HDAC8HDAC6
SCHEMBL5041089 0.81 KMT2A (0.68) PGRPTPN2PTPN1PTPN5MEN1
SCHEMBL5040088 0.81 PGR (0.61) PGRKDRAURKBPTPN2PTPN1
SCHEMBL1859217 0.81 PGR (0.68) PGRBRD4HSD17B2PKMMAP4K4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1250325-B1 PHENANTHRIDINE-N-OXIDES NYCOMED GMBH (DE) 2008-05-07 EP disclosed
US-6630483-B2 Phenanthridine-N-oxides ALTANA PHARMA AG (DE) 2003-10-07 US disclosed
US-20030105123-A1 For therapy of respiratory system disorders ALTANA PHARMA AG (DE) 2003-06-05 US disclosed
EP-1250325-A1 PHENANTHRIDINE-N-OXIDES ALTANA Pharma AG (DE) 2002-10-23 EP disclosed
EP-0889886-B1 NOVEL PHENANTHRIDINES SUBSTITUTED IN THE 6 POSITION ALTANA PHARMA AG (DE) 2002-09-18 EP disclosed
WO-2001051470-A1 PHENANTHRIDINE-N-OXIDES BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 2001-07-19 WO disclosed
US-6127378-A A PHOSPHODIESTERASE ENZYME INHIBITOR AS BRONCHIAL THERAPEUTICS, AN ANTIINFLAMMATORY AGENT TREATING ASTHMA PROPHYLAXIS, SKIN DISORDERS, INTESTINE DISORDERS, EYE DISORDERS, CENTRAL NERVOUS SYSTEM DISORDERS, JOINTS DISORDERS BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 2000-10-03 US disclosed
EP-0889886-A1 NOVEL PHENANTHRIDINES SUBSTITUTED IN THE 6 POSITION Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 1999-01-13 EP disclosed
WO-1997035854-A1 NOVEL PHENANTHRIDINES SUBSTITUTED IN THE 6 POSITION BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1997-10-02 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-20030105123-A1 For therapy of respiratory system disorders CHRM3, CYP11B1, CYP11B2 PGR 1707/4885BRD4 1368/4885HSD17B2 214/4885

“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.