SCHEMBL4758319

SCHEMBL4758319

CN1CCN(c2ccc(N/C=C3\C(=O)Nc4ccc(C(=O)c5cccc(C(N)=O)c5)cc43)cc2)CC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 1/20 0.42
CSF1R P07333 1/20 0.41
AKT2 P31751 1/20 0.41
NTRK1 P04629 2/20 0.40
NTRK3 Q16288 1/20 0.40
NPC1 O15118 4/20 0.39
RAB9A P51151 4/20 0.39
JAK3 P52333 1/20 0.39
TLK2 Q86UE8 1/20 0.39
NTRK2 Q16620 2/20 0.39
CHEK1 O14757 1/20 0.39
RET P07949 1/20 0.38
PTK2 Q05397 1/20 0.38
CDK4 P11802 2/20 0.38
CCND1 P24385 2/20 0.38
HTR7 P34969 1/20 0.38
RAF1 P04049 1/20 0.38
CCNT1 O60563 1/20 0.38
CDK9 P50750 1/20 0.38
CDK6 Q00534 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
SCHEMBL3573216 1.00 PDPK1 (0.42) PDPK1CSF1RAKT2NTRK1NTRK3
SCHEMBL3583076 0.94 CSF1R (0.47) CSF1RNTRK1NTRK3NPC1RAB9A
SCHEMBL3581951 0.94 CSF1R (0.43) PDPK1CSF1RNTRK1NTRK3NPC1
SCHEMBL3573222 0.91 FLT3 (0.43) CSF1RNTRK1NTRK3NPC1RAB9A
SCHEMBL3569087 0.90 PDGFRB (0.43) PDPK1CSF1RAKT2RAB9ATLK2
SCHEMBL4755940 0.90 PDGFRB (0.43) PDPK1CSF1RAKT2RAB9ATLK2
SCHEMBL3581952 0.89 CSF1R (0.43) CSF1RNTRK1NTRK3NPC1RAB9A
SCHEMBL4757425 0.88 JAK3 (0.47) PDPK1CSF1RAKT2NTRK1NTRK3
SCHEMBL4757422 0.88 JAK3 (0.47) PDPK1CSF1RAKT2NTRK1NTRK3
SCHEMBL3569691 0.88 CSF1R (0.49) CSF1RNTRK1NTRK3NPC1RAB9A

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 PDPK1 86/4885CSF1R 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.