SCHEMBL4877863

SCHEMBL4877863

O=C(O)c1ccc(Nc2cc(OC3CC3)ncn2)cc1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 1/20 0.46
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
AURKA O14965 2/20 0.44
EGFR P00533 5/20 0.43
ERBB3 P21860 5/20 0.43
FLT3 P36888 3/20 0.43
CDK2 P24941 1/20 0.43
CDK6 Q00534 1/20 0.43
EPHX2 P34913 4/20 0.42
AURKB Q96GD4 1/20 0.41
KMO O15229 1/20 0.41
FAAH O00519 2/20 0.40
HCAR3 P49019 1/20 0.40
ABL1 P00519 1/20 0.40
BCR P11274 1/20 0.40
GPR119 Q8TDV5 1/20 0.40

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
SCHEMBL5284948 0.92 FLT3 (0.41) S1PR1NPC1RAB9AAURKAEGFR
SCHEMBL4879483 0.87 EGFR (0.49) S1PR1NPC1RAB9AEGFRERBB3
SCHEMBL5283878 0.83 CES2 (0.42) S1PR1NPC1RAB9AEGFRERBB3
SCHEMBL5283876 0.81 EGFR (0.43) S1PR1NPC1RAB9AEGFRERBB3
SCHEMBL4872523 0.75 NPC1 (0.57) NPC1RAB9AAURKAEGFRERBB3
SCHEMBL4724653 0.75 NPC1 (0.55) NPC1RAB9AAURKAEGFRERBB3
SCHEMBL1070555 0.74 GPR119 (0.47) S1PR1EGFRFLT3CDK2CDK6
SCHEMBL5244511 0.73 NPC1 (0.56) NPC1RAB9AAURKAEGFRERBB3
SCHEMBL1830976 0.73 GPR119 (0.45) EGFRFLT3CDK2CDK6GPR119
SCHEMBL4873959 0.71 AURKA (0.50) NPC1RAB9AAURKAEGFRERBB3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080076771-A1 Thrombopoietin Receptor Agonists REITER LAWRENCE A 2008-03-27 US 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 (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-20080076771-A1 Thrombopoietin Receptor Agonists MPL, THPO, TBXA2R S1PR1 327/4885NPC1 4382/4885RAB9A 2219/4885

“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.