SCHEMBL1197553

SCHEMBL1197553

CN1CCN(c2ccc(Nc3ncc(F)c(Nc4cccc(OCC(N)=O)c4)n3)cc2C(N)=O)CC1

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SYK P43405 17/20 0.58
FLT3 P36888 1/20 0.58
BTK Q06187 1/20 0.58
CCNT1 O60563 1/20 0.54
CCNE1 P24864 1/20 0.54
CDK2 P24941 1/20 0.54
CDK9 P50750 1/20 0.54
EGFR P00533 1/20 0.52

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
SCHEMBL1196953 0.93 SYK (0.58) SYKFLT3BTKCCNT1CCNE1
SCHEMBL1197764 0.93 SYK (0.62) SYKFLT3BTKCCNT1CCNE1
SCHEMBL1197648 0.90 BTK (0.56) SYKFLT3BTKCCNT1CCNE1
SCHEMBL1198204 0.86 SYK (0.59) SYKFLT3BTKCCNT1CCNE1
SCHEMBL1197538 0.84 CCNT1 (0.72) SYKCCNT1CCNE1CDK2CDK9
SCHEMBL1197860 0.83 SYK (0.59) SYKFLT3BTKCCNT1CCNE1
SCHEMBL4002674 0.82 SYK (0.57) SYKFLT3BTKCCNT1CCNE1
SCHEMBL1197556 0.82 FLT3 (0.65) SYKFLT3BTKCDK2EGFR
SCHEMBL1198366 0.82 PAK1 (0.57) SYKFLT3BTKCCNT1CCNE1
SCHEMBL1197568 0.81 FLT3 (0.57) SYKFLT3BTKCCNT1CCNE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7834024-B2 Compositions and methods for inhibition of the JAK pathway RIGEL PHARMACEUTICALS, INC. (US) 2010-11-16 US claimed
US-20080260754-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS, INC. 2008-10-23 US claimed
WO-2008118823-A2 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS, INC. (US) 2008-10-02 WO claimed
US-8299087-B2 Compositions and methods for inhibition of the JAK pathway RIGEL PHARMACEUTICALS, INC. (US) 2012-10-30 US disclosed
US-20110027856-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS, INC. (US) 2011-02-03 US disclosed
US-7834024-B2 Compositions and methods for inhibition of the JAK pathway RIGEL PHARMACEUTICALS, INC. (US) 2010-11-16 US disclosed
US-20080260754-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS, INC. 2008-10-23 US disclosed
WO-2008118823-A2 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS, INC. (US) 2008-10-02 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-20080260754-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY JAK3, JAK2, JAK1 SYK 62/4885FLT3 46/4885BTK 10/4885

“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.