SCHEMBL3735191

SCHEMBL3735191

COc1cc(OC)c(Nc2ncnc3ncc(-c4ccccc4)nc23)cc1Cl

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
YES1 P07947 2/20 0.48
ABL1 P00519 1/20 0.48
STK17B O94768 1/20 0.45
MAPT P10636 5/20 0.43
JAK2 O60674 1/20 0.43
PIM1 P11309 1/20 0.43
CDK2 P24941 1/20 0.43
MAPKAPK2 P49137 1/20 0.43
GSK3A P49840 1/20 0.43
CSNK2A1 P68400 1/20 0.43
PAK1 Q13153 1/20 0.43
STK3 Q13188 1/20 0.43
DYRK1A Q13627 1/20 0.43
MAPKAPK3 Q16644 1/20 0.43
PRKD2 Q9BZL6 1/20 0.43
PLK3 Q9H4B4 1/20 0.43
ALDH1A1 P00352 2/20 0.43
GLA P06280 1/20 0.43
GAA P10253 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL13063721 0.89 YES1 (0.50) YES1ABL1STK17BMAPTPIM1
SCHEMBL14417707 0.85 YES1 (0.46) YES1ABL1STK17BMAPTPIM1
SCHEMBL3745373 0.81 MAPT (0.53) YES1STK17BMAPTALDH1A1GLA
SCHEMBL3742971 0.78 KDR (0.51) YES1ABL1STK17BMAPTDYRK1A
SCHEMBL3746874 0.74 PIK3CG (0.40) YES1ABL1STK17BMAPTALDH1A1
SCHEMBL13019110 0.72 APP (0.57) MAPTGLAGAASMN1; SMN2KDM4E
SCHEMBL3737557 0.70 MKNK2 (0.53) YES1MAPTALDH1A1GAASMN1; SMN2
SCHEMBL3541766 0.68 KDM4E (0.47) YES1ABL1MAPTALDH1A1GAA
Hydrochloric Acid SCHEMBL3736165 0.67 KDM4E (0.46) YES1ABL1MAPTALDH1A1GAA
SCHEMBL3734583 0.67 CSF1R (0.54) CDK2ALDH1A1SMN1; SMN2EGFRHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2039683-B1 Vasculostatic agents and methods of use thereof TARGEGEN INC (US) 2012-12-19 EP disclosed
US-20100330030-A1 Vasculostatic Agents and Methods of Use Thereof TARGEGEN, INC. (US) 2010-12-30 US disclosed
US-20100330030-A1 Vasculostatic Agents and Methods of Use Thereof TARGEGEN, INC. (US) 2010-12-30 US disclosed
US-20100278811-A1 VASCULOSTATIC AGENTS AND METHODS OF USE THEREOF TARGEGEN INC. 2010-11-04 US disclosed
US-20100278811-A1 VASCULOSTATIC AGENTS AND METHODS OF USE THEREOF TARGEGEN INC. 2010-11-04 US disclosed
EP-2039683-A2 Vasculostatic agents and methods of use thereof Targegen, Inc. (US) 2009-03-25 EP disclosed
EP-1549614-A4 VASCULOSTATIC AGENTS AND METHODS OF USE THEREOF TARGEGEN INC (US) 2008-04-16 EP disclosed
US-20070208019-A1 Vasculostatic agents and methods of use thereof TARGEGEN, INC. 2007-09-06 US disclosed
US-20070208019-A1 Vasculostatic agents and methods of use thereof TARGEGEN, INC. 2007-09-06 US disclosed
US-7208493-B2 Vasculostatic agents and methods of use thereof TARGEGEN, INC. (US) 2007-04-24 US disclosed
US-7208493-B2 Vasculostatic agents and methods of use thereof TARGEGEN, INC. (US) 2007-04-24 US disclosed
US-20050282814-A1 Vasculostatic agents and methods of use thereof TARGEGEN, INC. (US) 2005-12-22 US disclosed
EP-1549614-A2 VASCULOSTATIC AGENTS AND METHODS OF USE THEREOF Targegen, Inc. (US) 2005-07-06 EP disclosed
US-20040167198-A1 Vasculostatic agents and methods of use thereof TARGEGEN, INC. 2004-08-26 US disclosed
WO-2004030635-A2 VASCULOSTATIC AGENTS AND METHODS OF USE THEREOF TARGEGEN, INC. (US) 2004-04-15 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 (5 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-20100330030-A1 Vasculostatic Agents and Methods of Use Thereof RBP1, RBP4, VCAM1 YES1 2074/4885ABL1 4387/4885STK17B 4680/4885
US-20050282814-A1 Vasculostatic agents and methods of use thereof RBP1, RBP4, VCAM1 YES1 2074/4885ABL1 4387/4885STK17B 4680/4885
US-20070208019-A1 Vasculostatic agents and methods of use thereof RBP1, RBP4, VCAM1 YES1 2074/4885ABL1 4387/4885STK17B 4680/4885
US-20100278811-A1 VASCULOSTATIC AGENTS AND METHODS OF USE THEREOF RBP1, RBP4, VCAM1 YES1 2074/4885ABL1 4387/4885STK17B 4680/4885
US-20040167198-A1 Vasculostatic agents and methods of use thereof RBP1, RBP4, VCAM1 YES1 2074/4885ABL1 4387/4885STK17B 4680/4885

“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.