SCHEMBL5873124

SCHEMBL5873124

COC(=O)c1cc(-c2nc(-c3n[nH]c4ccccc34)sc2C)ccc1N1CCOCC1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 2/20 0.44
MAPT P10636 5/20 0.44
LRRK2 Q5S007 3/20 0.44
ALDH1A1 P00352 3/20 0.42
GAA P10253 2/20 0.42
ALOX15 P16050 2/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
MAPK1 P28482 1/20 0.41
ITK Q08881 1/20 0.41
KDM4E B2RXH2 1/20 0.40
LMNA P02545 1/20 0.40
POLB P06746 1/20 0.40
HPGD P15428 1/20 0.40
HTT P42858 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
FLT1 P17948 1/20 0.40

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
SCHEMBL5873032 0.91 FGFR1 (0.46) FGFR1LRRK2ALDH1A1GAAMAPK1
SCHEMBL5813034 0.80 LRRK2 (0.55) FGFR1MAPTLRRK2ALDH1A1GAA
SCHEMBL6506307 0.76 LRRK2 (0.53) FGFR1LRRK2MAPK1ITKFLT1
SCHEMBL5771326 0.74 MAP2K4 (0.47) FGFR1ALDH1A1GAAMAPK1ITK
SCHEMBL5872967 0.71 CDK2 (0.59) FGFR1MAPTALDH1A1GAAITK
SCHEMBL5770987 0.71 FGFR1 (0.53) FGFR1ITKFLT1
SCHEMBL5771063 0.70 LRRK2 (0.54) FGFR1MAPTLRRK2ALDH1A1GAA
SCHEMBL5872943 0.70 ALDH1A1 (0.43) FGFR1LRRK2ALDH1A1MEN1KMT2A
SCHEMBL5777277 0.69 KDM4E (0.63) FGFR1LRRK2ALDH1A1GAAMAPK1
SCHEMBL5873135 0.69 MAPK10 (0.52) FGFR1LRRK2ITKFLT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6984652-B2 Gyrase inhibitors WARNER-LAMBERT COMPANY LLC (US) 2006-01-10 US disclosed
US-20050250823-A1 Gyrase inhibitors YAGER KRAIG 2005-11-10 US disclosed
US-20050054697-A1 Gyrase inhibitors PFIZER INC. 2005-03-10 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 (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-20050054697-A1 Gyrase inhibitors TOP1, TOP2A, TOP2B FGFR1 3930/4885MAPT 3874/4885LRRK2 2922/4885
US-20050250823-A1 Gyrase inhibitors TOP1, TOP2A, TOP2B FGFR1 3930/4885MAPT 3874/4885LRRK2 2922/4885

“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.