SCHEMBL6770775

SCHEMBL6770775

CCOC(=O)c1cnc2c(I)cc(CN3CCOCC3)cc2c1O

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAD52 P43351 2/20 0.49
UHRF1 Q96T88 1/20 0.49
KMT2A Q03164 5/20 0.49
ALDH1A1 P00352 3/20 0.49
POLB P06746 2/20 0.49
MEN1 O00255 4/20 0.47
RXFP1 Q9HBX9 3/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
ATM Q13315 1/20 0.46
PKM P14618 1/20 0.45
MAPK1 P28482 3/20 0.45
KDM4E B2RXH2 2/20 0.45
HSD17B10 Q99714 2/20 0.45
TSHR P16473 1/20 0.45
USP2 O75604 1/20 0.44
TP53 P04637 1/20 0.44
RECQL P46063 1/20 0.44

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
SCHEMBL6727072 0.88 RAD52 (0.49) RAD52UHRF1KMT2AALDH1A1POLB
SCHEMBL6732194 0.87 RXFP1 (0.46) RAD52UHRF1KMT2AALDH1A1POLB
SCHEMBL6610256 0.87 RAD52 (0.48) RAD52UHRF1KMT2AALDH1A1POLB
SCHEMBL6724236 0.86 RAD52 (0.45) RAD52UHRF1KMT2AALDH1A1POLB
SCHEMBL6770420 0.83 PDE4B (0.43) RAD52UHRF1KMT2AALDH1A1POLB
SCHEMBL6605450 0.81 KMT2A (0.46) RAD52UHRF1KMT2AALDH1A1POLB
SCHEMBL6724134 0.81 ALDH1A1 (0.46) RAD52UHRF1KMT2AALDH1A1POLB
SCHEMBL6769426 0.78 KMT2A (0.39) KMT2AALDH1A1MEN1SMN1; SMN2KDM4E
SCHEMBL6770778 0.76 KCNH2 (0.53) ALDH1A1RXFP1TSHR
SCHEMBL7938727 0.70 KMT2A (0.50) RAD52KMT2AALDH1A1POLBMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6683181-B2 MIXING POLYSTYRENE-TOSYL CHLORIDE RESIN WITH C2-12ALKYNOL; REACTING WITH AMINE TO MAKE CHEMICAL INTERMEDIATE; HERPES VIRUS TREATMENT PHARMACIA AND UPJOHN COMAPNY 2004-01-27 US disclosed
US-20030153561-A1 Pyrroloquinolones as antiviral agents VAILLANCOURT VALERIE A (US) 2003-08-14 US disclosed
EP-1299386-A1 PYRROLOQUINOLONES AS ANTIVIRAL AGENTS PHARMACIA & UPJOHN COMPANY (US) 2003-04-09 EP disclosed
US-6525049-B2 Such as N-(4-chlorobenzyl)-2-(hydroxymethyl)-6-oxo-6H-pyrrolo (3,2,1-ij)quinoline-5-carboxamide for treatment of herpes PHARMACIA & UPJOHN COMPANY 2003-02-25 US disclosed
US-20020055636-A1 Pyrroloquinolones as antiviral agents PHARMACIA & UPJOHN COMPANY 2002-05-09 US disclosed
WO-2002002558-A1 PYRROLOQUINOLONES AS ANTIVIRAL AGENTS PHARMACIA & UPJOHN COMPANY (US) 2002-01-10 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 (2 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-20030153561-A1 Pyrroloquinolones as antiviral agents ZC3HAV1, ZC3HAV1L, IRF3 RAD52 754/4885UHRF1 733/4885KMT2A 2367/4885
US-20020055636-A1 Pyrroloquinolones as antiviral agents ZC3HAV1, ZC3HAV1L, IRF3 RAD52 754/4885UHRF1 733/4885KMT2A 2367/4885

“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.