SCHEMBL6800669

SCHEMBL6800669

O=c1c(Cc2cccnc2)nc2cccnc2n1-c1cccc(C=Cc2ccccn2)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.42
RAB9A P51151 3/20 0.42
MEN1 O00255 3/20 0.42
NPC1 O15118 2/20 0.42
PSD A5PKW4 1/20 0.41
POLB P06746 2/20 0.41
MAPT P10636 4/20 0.40
ALDH1A1 P00352 4/20 0.40
KDM4E B2RXH2 2/20 0.40
HKDC1 Q2TB90 2/20 0.40
RAD1 O60671 1/20 0.40
CFTR P13569 1/20 0.40
APEX1 P27695 1/20 0.40
CASP6 P55212 1/20 0.40
RAD51 Q06609 1/20 0.40
GOPC Q9HD26 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
USP2 O75604 3/20 0.40
CYP1A2 P05177 2/20 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
SCHEMBL6800663 1.00 KMT2A (0.42) KMT2ARAB9AMEN1NPC1PSD
SCHEMBL7359417 0.97 KMT2A (0.42) KMT2ARAB9AMEN1NPC1PSD
SCHEMBL6797072 0.94 PSD (0.45) KMT2AMEN1PSDMAPTALDH1A1
SCHEMBL6797066 0.94 PSD (0.45) KMT2AMEN1PSDMAPTALDH1A1
SCHEMBL6798020 0.93 PSD (0.46) KMT2ARAB9AMEN1NPC1PSD
SCHEMBL6798012 0.93 PSD (0.46) KMT2ARAB9AMEN1NPC1PSD
SCHEMBL6952747 0.91 CYSLTR2 (0.40) KMT2ARAB9ANPC1PSDMAPT
SCHEMBL6952742 0.91 CYSLTR2 (0.40) KMT2ARAB9ANPC1PSDMAPT
SCHEMBL6796463 0.91 PSD (0.40) KMT2ARAB9AMEN1PSDMAPT
SCHEMBL6796476 0.91 PSD (0.40) KMT2ARAB9AMEN1PSDMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6727245-B2 4-(HETERO)ARYL-3-OXO-3,4-DIHYDROPYRIDO(2,3-B)PYRAZINE DERIVATIVES; PROPHYLACTIC OR THERAPEUTIC TREATMENT OF PHOSPHODIESTERASE IV AND TUMOR NECROSIS FACTOR MEDIATED DISEASES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-04-27 US disclosed
EP-0770079-B1 HETEROBICYCLIC DERIVATIVES FUJISAWA PHARMACEUTICAL CO (JP) 2003-02-12 EP disclosed
US-20020107251-A1 Heterobicyclic derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-08-08 US disclosed
US-6426345-B1 PHOSPHODIESTERASE INHIBITORS; ANTIINFLAMMATORY AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-07-30 US disclosed
EP-0920867-A1 Pyrido[2,3-a]pyrazine derivatives as PDE-IV and TNF inhibitors FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-06-09 EP disclosed
WO-1996001825-A1 HETEROBICYCLIC DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-01-25 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-20020107251-A1 Heterobicyclic derivatives ARSA, ARRB1, SULT2A1 KMT2A 968/4885RAB9A 1092/4885MEN1 2703/4885

“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.