SCHEMBL4758073

SCHEMBL4758073

Cc1cccc(C(=O)Nc2cccc(C(=O)c3ccc4c(c3)NC(=O)/C4=C/Nc3ccc(N4CCN(C)CC4)cc3)c2)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 4/20 0.55
NTRK3 Q16288 1/20 0.55
NTRK2 Q16620 3/20 0.48
NPC1 O15118 6/20 0.47
PKM P14618 1/20 0.47
CSF1R P07333 1/20 0.46
RAB9A P51151 5/20 0.46
KDM4E B2RXH2 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
KMT2A Q03164 2/20 0.46
TP53 P04637 1/20 0.44
HTR1D P28221 1/20 0.43
HTR1B P28222 1/20 0.43
HTR2A P28223 1/20 0.43
MAPT P10636 2/20 0.42
USP2 O75604 1/20 0.42
MAPK1 P28482 1/20 0.42
ESR2 Q92731 1/20 0.42
TAAR1 Q96RJ0 1/20 0.42
MAPK14 Q16539 1/20 0.42

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
SCHEMBL4703080 1.00 NTRK1 (0.55) NTRK1NTRK3NTRK2NPC1PKM
SCHEMBL4706345 0.95 NTRK1 (0.54) NTRK1NTRK3NTRK2NPC1CSF1R
SCHEMBL4758964 0.95 NTRK1 (0.54) NTRK1NTRK3NTRK2NPC1CSF1R
SCHEMBL4706534 0.93 CSF1R (0.53) NTRK1NTRK3NTRK2NPC1CSF1R
SCHEMBL4757149 0.93 CSF1R (0.53) NTRK1NTRK3NTRK2NPC1CSF1R
SCHEMBL4757933 0.93 NPC1 (0.52) NTRK1NTRK3NTRK2NPC1CSF1R
SCHEMBL4757936 0.93 NPC1 (0.52) NTRK1NTRK3NTRK2NPC1CSF1R
SCHEMBL5428287 0.92 NTRK1 (0.52) NTRK1NTRK3NTRK2NPC1CSF1R
SCHEMBL4705875 0.92 NTRK1 (0.52) NTRK1NTRK3NTRK2NPC1CSF1R
SCHEMBL4759351 0.92 NTRK1 (0.49) NTRK1NTRK3NTRK2NPC1CSF1R

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 3 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

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-20070032478-A1 Kinase Inhibitors ABL1, LCK, ERBB2 NTRK1 413/4885NTRK3 418/4885NTRK2 720/4885

“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.