SCHEMBL3585200

SCHEMBL3585200

CCN(CC)CCCOc1ccc(NC=C2C(=O)Nc3cc(C(=O)c4cccc(N)c4)ccc32)cc1F

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDR P35968 7/20 0.41
FLT3 P36888 6/20 0.40
PSEN1 P49768 1/20 0.34
PSEN2 P49810 1/20 0.34
APH1B Q8WW43 1/20 0.34
NCSTN Q92542 1/20 0.34
APH1A Q96BI3 1/20 0.34
PSENEN Q9NZ42 1/20 0.34
PRKAA2 P54646 1/20 0.34
PRKAA1 Q13131 1/20 0.34
AURKB Q96GD4 1/20 0.33
KIT P10721 1/20 0.33
MCHR1 Q99705 1/20 0.33
BCHE P06276 1/20 0.33
ACHE P22303 1/20 0.33
HRH3 Q9Y5N1 1/20 0.33
PIM1 P11309 1/20 0.33
CHEK1 O14757 2/20 0.32

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
SCHEMBL3585194 0.93 KDR (0.42) KDRFLT3PSEN1PSEN2APH1B
SCHEMBL3573602 0.89 FLT3 (0.41) KDRFLT3PSEN1PSEN2APH1B
SCHEMBL3582272 0.85 FLT3 (0.45) KDRFLT3PSEN1PSEN2APH1B
SCHEMBL4996990 0.83 FLT3 (0.49) KDRFLT3PSEN1PSEN2APH1B
SCHEMBL4996983 0.83 FLT3 (0.49) KDRFLT3PSEN1PSEN2APH1B
SCHEMBL4991428 0.82 FLT3 (0.52) KDRFLT3PSEN1PSEN2APH1B
SCHEMBL4991434 0.82 FLT3 (0.52) KDRFLT3PSEN1PSEN2APH1B
SCHEMBL3573599 0.82 IKBKB (0.43) KDRFLT3PSEN1PSEN2APH1B
SCHEMBL4706315 0.81 KDR (0.41) KDRFLT3PSEN1PSEN2APH1B
SCHEMBL4995979 0.79 FLT3 (0.51) KDRFLT3PSEN1PSEN2APH1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1902025-A1 KINASE INHIBITORS Allergan, Inc. (US) 2008-03-26 EP claimed
US-20070032478-A1 Kinase Inhibitors ALLERGAN, INC. 2007-02-08 US claimed
WO-2007008895-A1 KINASE INHIBITORS ALLERGAN, INC. (US) 2007-01-18 WO claimed
US-7749530-B2 Kinase inhibitors ALLERGAN, INC. (US) 2010-07-06 US disclosed
WO-2010075197-A1 KINASE INHIBITORS ALLERGAN, INC. (US) 2010-07-01 WO disclosed
US-7692005-B2 Kinase inhibitors ALLERGAN, INC. (US) 2010-04-06 US disclosed
US-20090208557-A1 Kinase inhibitors ALLERGAN, INC. 2009-08-20 US disclosed
EP-1902025-A1 KINASE INHIBITORS Allergan, Inc. (US) 2008-03-26 EP disclosed
US-20070032478-A1 Kinase Inhibitors ALLERGAN, INC. 2007-02-08 US disclosed
WO-2007008895-A1 KINASE INHIBITORS ALLERGAN, INC. (US) 2007-01-18 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-20090208557-A1 Kinase inhibitors PTK2, MAP3K6, MAP3K20 KDR 51/4885FLT3 380/4885PSEN1 3502/4885
US-20070032478-A1 Kinase Inhibitors ABL1, LCK, ERBB2 KDR 226/4885FLT3 87/4885PSEN1 3972/4885

“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.