SCHEMBL835197

SCHEMBL835197

Cn1c(=O)cc(Sc2ccc(Cl)cc2)c2cc(F)ccc21

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 5/20 0.49
RHEB Q15382 2/20 0.49
PTGDR2 Q9Y5Y4 2/20 0.46
AKR1B1 P15121 1/20 0.46
KDM4E B2RXH2 1/20 0.44
HTT P42858 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
ALDH1A1 P00352 1/20 0.44
MAPT P10636 3/20 0.42
NPSR1 Q6W5P4 2/20 0.42
LMNA P02545 1/20 0.42
HPGD P15428 1/20 0.42
ALOX15 P16050 1/20 0.42
TSHR P16473 1/20 0.42
NOD2 Q9HC29 1/20 0.42
ATM Q13315 1/20 0.40
USP2 O75604 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39

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
SCHEMBL835002 0.92 RXFP1 (0.45) RXFP1RHEBPTGDR2AKR1B1KDM4E
SCHEMBL835001 0.88 RXFP1 (0.44) RXFP1RHEBPTGDR2AKR1B1KDM4E
SCHEMBL836059 0.85 RHEB (0.50) RXFP1RHEBPTGDR2KDM4EHTT
SCHEMBL835184 0.83 KDM4E (0.58) RXFP1RHEBKDM4EHTTSMN1; SMN2
SCHEMBL835284 0.83 RXFP1 (0.43) RXFP1RHEBKDM4EHTTSMN1; SMN2
SCHEMBL836042 0.82 HTT (0.49) RXFP1RHEBPTGDR2KDM4EHTT
SCHEMBL836028 0.81 KDM4E (0.51) RXFP1KDM4EHTTALDH1A1MAPT
SCHEMBL835229 0.78 NQO2 (0.42) RXFP1RHEBPTGDR2AKR1B1KDM4E
SCHEMBL836066 0.76 RXFP1 (0.48) RXFP1RHEBPTGDR2AKR1B1KDM4E
SCHEMBL23579635 0.75 ATM (0.45) RXFP1KDM4EHTTSMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8143276-B2 4-thio substituted quinoline and naphthyridine compounds XTL BIOPHARMACEUTICALS LTD. (IL) 2012-03-27 US disclosed
US-8143276-B2 4-thio substituted quinoline and naphthyridine compounds XTL BIOPHARMACEUTICALS LTD. (IL) 2012-03-27 US disclosed
US-20090054477-A1 4-thio substituted quinoline and naphthyridine compounds PRESIDIO PHARMACEUTICALS, INC. 2009-02-26 US disclosed
US-20090054477-A1 4-thio substituted quinoline and naphthyridine compounds PRESIDIO PHARMACEUTICALS, INC. 2009-02-26 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-20090054477-A1 4-thio substituted quinoline and naphthyridine compounds GTF3C4, HNF4A, TENT4A RXFP1 4782/4885RHEB 2734/4885PTGDR2 4481/4885

“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.