SCHEMBL13508624

SCHEMBL13508624

Cc1cc2nc(/C=C/c3ccncc3)[nH]c2cc1C

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 9/20 0.73
▸ KMT2A Q03164 7/20 0.73
▸ MEN1 O00255 6/20 0.73
▸ KDM4E B2RXH2 4/20 0.73
▸ ATM Q13315 2/20 0.73
▸ CACNA1B Q00975 1/20 0.73
▸ APBA1 Q02410 1/20 0.73
▸ MCL1 Q07820 1/20 0.73
▸ NPC1 O15118 4/20 0.71
▸ RAB9A P51151 4/20 0.71
▸ LMNA P02545 4/20 0.52
▸ MAPK1 P28482 1/20 0.52
▸ TP53 P04637 1/20 0.49
▸ ALDH1A1 P00352 2/20 0.46
▸ PKM P14618 2/20 0.46
▸ HPGD P15428 2/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ HSP90AA1 P07900 1/20 0.46
▸ ALOX5 P09917 1/20 0.45
▸ APP P05067 3/20 0.45

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
SCHEMBL6836616 0.86 KDM4E (0.75) MAPTKMT2AMEN1KDM4EATM
SCHEMBL6836889 0.86 KDM4E (0.75) MAPTKMT2AMEN1KDM4EATM
SCHEMBL20184766 0.85 MAPT (1.00) MAPTKMT2AMEN1KDM4EATM
SCHEMBL20184767 0.85 MAPT (1.00) MAPTKMT2AMEN1KDM4EATM
SCHEMBL2458503 0.83 RAB9A (1.00) MAPTKMT2AMEN1KDM4EATM
SCHEMBL2458502 0.83 RAB9A (1.00) MAPTKMT2AMEN1KDM4EATM
SCHEMBL9833191 0.74 PDE4A (0.58) MAPTKMT2AMEN1KDM4EATM
SCHEMBL7623659 0.72 MEN1 (0.67) MAPTKMT2AMEN1KDM4EMCL1
SCHEMBL7623671 0.72 MEN1 (0.67) MAPTKMT2AMEN1KDM4EMCL1
SCHEMBL4623517 0.72 MEN1 (0.72) MAPTKMT2AMEN1KDM4EATM

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-20100028299-A1 Methods and compositions of treating a flaviviridae family viral infection THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY 2010-02-04 — — US disclosed
US-20100028299-A1 Methods and compositions of treating a flaviviridae family viral infection THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY 2010-02-04 — — 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-20100028299-A1 Methods and compositions of treating a flaviviridae family viral infection EIF2AK2, NSUN3, NSUN2 MAPT 4569/4885KMT2A 2858/4885MEN1 4880/4885

“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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