SCHEMBL1866800

SCHEMBL1866800

[C-]#[N+]c1cc(Br)ccc1NCCN1CCOCC1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ LMNA P02545 4/20 0.43
▸ HPGD P15428 2/20 0.42
▸ SMARCA2 P51531 2/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ MITF O75030 1/20 0.42
▸ POLB P06746 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ ACP1 P24666 1/20 0.42
▸ GLA P06280 2/20 0.41
▸ ABL1 P00519 1/20 0.41
▸ RIN1 Q13671 1/20 0.41
▸ EGFR P00533 1/20 0.41
▸ KDM4E B2RXH2 2/20 0.41
▸ TSHR P16473 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41

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
SCHEMBL2942637 0.83 AAK1 (0.48) KMT2ASMN1; SMN2LMNAHPGDSMARCA2
SCHEMBL1519175 0.77 KMT2A (0.46) KMT2ASMN1; SMN2LMNAHPGDSMARCA2
SCHEMBL13284307 0.77 KMT2A (0.43) KMT2ASMN1; SMN2LMNAHPGDSMARCA2
SCHEMBL1858932 0.77 PIK3CD (0.51) KMT2ASMN1; SMN2LMNAHPGDSMARCA2
SCHEMBL17678277 0.75 LMNA (0.52) KMT2ALMNAPOLBACP1GLA
SCHEMBL4039191 0.75 MAPT (0.66) KMT2ASMN1; SMN2LMNAMEN1POLB
SCHEMBL9107823 0.75 SMN1; SMN2 (0.57) KMT2ASMN1; SMN2LMNAMEN1ABL1
SCHEMBL16044320 0.72 MAPT (0.61) KMT2ALMNAMEN1POLBKDM4E
SCHEMBL14247587 0.70 LMNA (0.52) KMT2ALMNAPOLBACP1GLA
SCHEMBL4069514 0.70 SIGMAR1 (0.44) KMT2ASMARCA2MEN1POLBACP1

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-2049503-B1 QUINAZOLINE AND PYRIDOPYRIMIDINE DERIVATIVES AS P38 KINASE INHIBITORS AMGEN INC (US) 2012-12-19 — — EP disclosed
US-7935709-B2 2-quinazolinone compounds and methods of use AMGEN INC. (US) 2011-05-03 — — US disclosed
US-20080032973-A1 2-Quinazolinone compounds and methods of use AMGEN INC. (US) 2008-02-07 — — 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-20080032973-A1 2-Quinazolinone compounds and methods of use MAP3K1, MAP3K2, MAP3K7 KMT2A 1607/4885SMN1; SMN2 4054/4885LMNA 1458/4885

“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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