SCHEMBL3580559

SCHEMBL3580559

NC(=O)c1ccc(C(=O)c2ccc3c(c2)C(=CNc2ccc(N4CCOCC4)cc2)C(=O)N3)cc1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 2/20 0.43
CSF1R P07333 1/20 0.42
AKT2 P31751 1/20 0.41
JAK2 O60674 2/20 0.40
PDPK1 O15530 1/20 0.40
PAK1 Q13153 5/20 0.40
TLK2 Q86UE8 2/20 0.39
ERBB2 P04626 1/20 0.39
RET P07949 1/20 0.39
FLT3 P36888 1/20 0.39
AURKB Q96GD4 1/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.38
RAF1 P04049 1/20 0.38

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
SCHEMBL4755940 0.94 PDGFRB (0.43) PDGFRBCSF1RAKT2PDPK1PAK1
SCHEMBL3569087 0.94 PDGFRB (0.43) PDGFRBCSF1RAKT2PDPK1PAK1
SCHEMBL3573943 0.94 CSF1R (0.49) PDGFRBCSF1RJAK2ERBB2RET
SCHEMBL3580563 0.93 PDGFRB (0.43) PDGFRBCSF1RAKT2PAK1TLK2
SCHEMBL3581951 0.90 CSF1R (0.43) CSF1RPDPK1TLK2RETFLT3
SCHEMBL3581682 0.89 JAK3 (0.48) PDGFRBCSF1RPDPK1RETKDM4E
SCHEMBL3581679 0.89 JAK3 (0.48) PDGFRBCSF1RPDPK1RETKDM4E
SCHEMBL3570303 0.88 AKT2 (0.43) PDGFRBCSF1RAKT2JAK2PAK1
SCHEMBL3569089 0.88 PDGFRB (0.43) PDGFRBCSF1RAKT2PAK1TLK2
SCHEMBL3578295 0.87 CSF1R (0.47) PDGFRBCSF1RJAK2ERBB2RET

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7692005-B2 Kinase inhibitors ALLERGAN, INC. (US) 2010-04-06 US claimed
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 PDGFRB 368/4885CSF1R 776/4885AKT2 94/4885
US-20070032478-A1 Kinase Inhibitors ABL1, LCK, ERBB2 PDGFRB 407/4885CSF1R 877/4885AKT2 168/4885

“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.