SCHEMBL3569089

SCHEMBL3569089

Nc1cccc(C(=O)c2ccc3c(c2)C(=CNc2ccc(N4CCOCC4)cc2)C(=O)N3)c1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 2/20 0.43
ERBB2 P04626 1/20 0.41
RET P07949 1/20 0.41
CSF1R P07333 1/20 0.41
RORC P51449 1/20 0.40
TLK2 Q86UE8 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
NPC1 O15118 1/20 0.39
MAPT P10636 2/20 0.39
RAB9A P51151 2/20 0.39
ALOX12 P18054 1/20 0.39
AKT2 P31751 1/20 0.38
AURKB Q96GD4 1/20 0.38
RAF1 P04049 1/20 0.38
PAK1 Q13153 3/20 0.38
KMO O15229 1/20 0.38
HTT P42858 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
SCHEMBL3578299 0.93 CSF1R (0.46) PDGFRBERBB2RETCSF1RRORC
SCHEMBL3580563 0.92 PDGFRB (0.43) PDGFRBERBB2RETCSF1RTLK2
SCHEMBL4755940 0.91 PDGFRB (0.43) PDGFRBERBB2RETCSF1RRORC
SCHEMBL3569087 0.91 PDGFRB (0.43) PDGFRBERBB2RETCSF1RRORC
SCHEMBL3573222 0.90 FLT3 (0.43) RETCSF1RTLK2SMN1; SMN2NPC1
SCHEMBL3580559 0.88 PDGFRB (0.43) PDGFRBERBB2RETCSF1RTLK2
SCHEMBL3571619 0.87 JAK3 (0.46) PDGFRBRETCSF1RMAPTRAB9A
SCHEMBL3571618 0.87 JAK3 (0.46) PDGFRBRETCSF1RMAPTRAB9A
SCHEMBL3581682 0.85 JAK3 (0.48) PDGFRBRETCSF1RSMN1; SMN2NPC1
SCHEMBL3578295 0.85 CSF1R (0.47) PDGFRBERBB2RETCSF1RRORC

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 368/4885ERBB2 6/4885RET 93/4885
US-20070032478-A1 Kinase Inhibitors ABL1, LCK, ERBB2 PDGFRB 407/4885ERBB2 3/4885RET 41/4885

“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.