SCHEMBL1509531

SCHEMBL1509531

COc1ncccc1-c1ccc2[nH]c(-c3nc4cc(N5CCN(C)CC5)ccc4[nH]3)nc2c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.50
▸ SMN1; SMN2 Q16637 4/20 0.50
▸ KDM4E B2RXH2 4/20 0.50
▸ RAB9A P51151 2/20 0.50
▸ NPC1 O15118 1/20 0.50
▸ POLB P06746 1/20 0.50
▸ MAPT P10636 3/20 0.48
▸ MEN1 O00255 2/20 0.48
▸ BLM P54132 2/20 0.48
▸ KMT2A Q03164 2/20 0.48
▸ GAA P10253 1/20 0.48
▸ RXFP1 Q9HBX9 1/20 0.48
▸ DHFR P00374 1/20 0.47
▸ HRH4 Q9H3N8 1/20 0.47
▸ FGFR1 P11362 2/20 0.47
▸ FLT1 P17948 1/20 0.47
▸ SLCO2B1 O94956 1/20 0.46
▸ GLA P06280 1/20 0.46
▸ RECQL P46063 1/20 0.46
▸ BCL2L1 Q07817 1/20 0.46

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
SCHEMBL14090230 0.83 ALDH1A1 (0.55) ALDH1A1SMN1; SMN2KDM4ERAB9ANPC1
SCHEMBL12833685 0.81 PRMT5 (0.50) ALDH1A1SMN1; SMN2KDM4ERAB9ANPC1
SCHEMBL12834289 0.80 LOXL2 (0.41) ALDH1A1SMN1; SMN2KDM4ERAB9ANPC1
SCHEMBL14089973 0.79 LOXL2 (0.38) ALDH1A1SMN1; SMN2KDM4ERAB9ANPC1
SCHEMBL14090417 0.79 NPC1 (0.46) ALDH1A1SMN1; SMN2RAB9ANPC1POLB
SCHEMBL14892215 0.78 ALDH1A1 (0.60) ALDH1A1SMN1; SMN2KDM4ERAB9ANPC1
SCHEMBL14090432 0.78 IRAK4 (0.45) ALDH1A1SMN1; SMN2KDM4ERAB9ANPC1
SCHEMBL14669391 0.78 ALDH1A1 (0.67) ALDH1A1SMN1; SMN2KDM4ERAB9ANPC1
SCHEMBL14892245 0.78 CBFB (0.57) ALDH1A1SMN1; SMN2KDM4ERAB9ANPC1
SCHEMBL1552158 0.77 ALDH1A1 (0.65) ALDH1A1SMN1; SMN2KDM4ERAB9ANPC1

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-8629147-B2 Heterocyclic compounds useful in the treatment of neoplastic diseases, inflammatory disorders and immunomodulatory disorders CHEMBRIDGE CORPORATION (US) 2014-01-14 — — US disclosed
US-8629147-B2 Heterocyclic compounds useful in the treatment of neoplastic diseases, inflammatory disorders and immunomodulatory disorders CHEMBRIDGE CORPORATION (US) 2014-01-14 — — US disclosed
US-8629147-B2 Heterocyclic compounds useful in the treatment of neoplastic diseases, inflammatory disorders and immunomodulatory disorders CHEMBRIDGE CORPORATION (US) 2014-01-14 — — US disclosed
EP-2298770-A1 Heterocyclic compounds as TrkA modulators ChemBridge Corporation (US) 2011-03-23 — — EP disclosed
EP-2298770-A1 Heterocyclic compounds as TrkA modulators ChemBridge Corporation (US) 2011-03-23 — — EP disclosed
US-20080207635-A1 Heterocyclic compounds useful in the treatment of neoplastic diseases, inflammatory disorders and immunomodulatory disorders CHEMBRIDGE CORPORATION 2008-08-28 — — US disclosed
US-20080207635-A1 Heterocyclic compounds useful in the treatment of neoplastic diseases, inflammatory disorders and immunomodulatory disorders CHEMBRIDGE CORPORATION 2008-08-28 — — US disclosed
US-20080207635-A1 Heterocyclic compounds useful in the treatment of neoplastic diseases, inflammatory disorders and immunomodulatory disorders CHEMBRIDGE CORPORATION 2008-08-28 — — US disclosed
EP-1960382-A1 HETEROCYCLIC COMPOUNDS AS TYROSINE KINASE MODULATORS ChemBridge Research Laboratories, Inc. (US) 2008-08-27 — — EP disclosed
WO-2007056155-A1 HETEROCYCLIC COMPOUNDS AS TYROSINE KINASE MODULATORS CHEMBRIDGE RESEARCH LABORATORIES, INC. (US) 2007-05-18 — — WO disclosed
WO-2007056155-A1 HETEROCYCLIC COMPOUNDS AS TYROSINE KINASE MODULATORS CHEMBRIDGE RESEARCH LABORATORIES, INC. (US) 2007-05-18 — — 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 (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-20080207635-A1 Heterocyclic compounds useful in the treatment of neoplastic diseases, inflammatory disorders and immunomodulatory disorders LCK, MALT1, MYD88 ALDH1A1 2293/4885SMN1; SMN2 3752/4885KDM4E 2432/4885

“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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