SCHEMBL5748633

SCHEMBL5748633

Cc1nc(-c2n[nH]c3ccccc23)sc1-c1ccc(N2CCN(C)CC2)cc1

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 2/20 0.53
FLT1 P17948 2/20 0.53
MAP4K1 Q92918 12/20 0.49
JAK2 O60674 1/20 0.47
JAK3 P52333 1/20 0.43
ITK Q08881 1/20 0.42
LRRK2 Q5S007 1/20 0.42
MELK Q14680 1/20 0.42

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
SCHEMBL5771063 0.90 LRRK2 (0.54) FGFR1FLT1MAP4K1ITKLRRK2
SCHEMBL5770987 0.86 FGFR1 (0.53) FGFR1FLT1MAP4K1JAK2JAK3
SCHEMBL5872977 0.86 TNKS (0.46) FGFR1FLT1MAP4K1LRRK2
SCHEMBL18930828 0.83 FGFR1 (0.63) FGFR1FLT1MAP4K1JAK2JAK3
SCHEMBL5872971 0.80 KDM4E (0.44) FGFR1FLT1JAK2ITKLRRK2
SCHEMBL5813034 0.76 LRRK2 (0.55) FGFR1FLT1MAP4K1ITKLRRK2
SCHEMBL5873090 0.75 PLK4 (0.47) FGFR1FLT1MAP4K1
SCHEMBL5774743 0.74 IDO1 (0.43) FGFR1FLT1JAK2ITKLRRK2
SCHEMBL5773591 0.73 JAK2 (0.47) JAK2JAK3ITKLRRK2
SCHEMBL5772793 0.72 JAK2 (0.43) FGFR1JAK2ITKMELK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1664040-A1 GYRASE INHIBITORS PFIZER INC. (US) 2006-06-07 EP disclosed
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
WO-2005026162-A1 GYRASE INHIBITORS PFIZER INC. (US) 2005-03-24 WO 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 3930/4885FLT1 4235/4885MAP4K1 2486/4885
US-20050250823-A1 Gyrase inhibitors TOP1, TOP2A, TOP2B FGFR1 3930/4885FLT1 4235/4885MAP4K1 2486/4885

“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.