SCHEMBL4493575

SCHEMBL4493575

CCCc1ccc(Oc2ncncc2C(=O)Nc2c(C)cccc2C)c(OC)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.45
▸ MAPK1 P28482 3/20 0.45
▸ LMNA P02545 3/20 0.45
▸ MEN1 O00255 2/20 0.45
▸ SMN1; SMN2 Q16637 2/20 0.45
▸ MAPT P10636 2/20 0.45
▸ KDM4E B2RXH2 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ GAA P10253 1/20 0.45
▸ HTT P42858 1/20 0.45
▸ L3MBTL1 Q9Y468 2/20 0.42
▸ POLB P06746 1/20 0.42
▸ RXFP1 Q9HBX9 1/20 0.42
▸ NPC1 O15118 2/20 0.41
▸ RAB9A P51151 2/20 0.41
▸ GPBAR1 Q8TDU6 1/20 0.41
▸ PDE4A P27815 1/20 0.40
▸ PDE4B Q07343 1/20 0.40
▸ PDE4C Q08493 1/20 0.40
▸ PDE4D Q08499 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
SCHEMBL4496196 0.81 NPC1 (0.45) KMT2AMAPK1LMNAMEN1SMN1; SMN2
SCHEMBL4494707 0.77 LCK (0.51) KMT2AMAPK1LMNAMEN1SMN1; SMN2
SCHEMBL4480855 0.77 LCK (0.43) KMT2AMAPK1LMNAMEN1SMN1; SMN2
SCHEMBL4498945 0.76 JAK3 (0.47) KMT2AMAPK1LMNAMEN1SMN1; SMN2
SCHEMBL4493453 0.75 LCK (0.63) MAPK1
SCHEMBL4499105 0.75 LCK (0.48) KMT2AMAPK1LMNAMEN1SMN1; SMN2
SCHEMBL4488034 0.75 LCK (0.53) —
SCHEMBL4505987 0.74 LCK (0.48) KMT2AMEN1MAPT
SCHEMBL4507879 0.74 BTK (0.52) —
SCHEMBL4501786 0.74 LCK (0.54) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7504396-B2 Substituted heterocyclic compounds and methods of use AMGEN INC. (US) 2009-03-17 — — US disclosed
US-20050209221-A1 Substituted heterocyclic compounds and methods of use AMGEN INC. 2005-09-22 — — 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-20050209221-A1 Substituted heterocyclic compounds and methods of use ICOS, CD4, HLA-DRB1 KMT2A 2883/4885MAPK1 2666/4885LMNA 4129/4885

“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.

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