SCHEMBL6797722

SCHEMBL6797722

CCOC(=O)c1cccc(Nc2ncccc2N)c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC25B P30305 4/20 0.63
MAPT P10636 7/20 0.61
SMN1; SMN2 Q16637 5/20 0.61
LMNA P02545 3/20 0.61
POLB P06746 1/20 0.61
BRAF P15056 1/20 0.60
TP53 P04637 4/20 0.58
NPC1 O15118 4/20 0.58
RAB9A P51151 4/20 0.58
KDM4E B2RXH2 2/20 0.58
HPGD P15428 3/20 0.57
PPIA P62937 1/20 0.55
KMT2A Q03164 3/20 0.55
MEN1 O00255 2/20 0.55
ALDH1A1 P00352 2/20 0.55
HTT P42858 1/20 0.55
UBE2N P61088 1/20 0.55
NPSR1 Q6W5P4 1/20 0.55
THRB P10828 1/20 0.53
NFKB1 P19838 1/20 0.52

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
SCHEMBL6797385 0.88 ROCK1 (0.60) CDC25BMAPTSMN1; SMN2LMNAPOLB
SCHEMBL527470 0.86 RAB9A (0.67) MAPTSMN1; SMN2LMNAPOLBTP53
SCHEMBL6797018 0.82 MEN1 (0.51) MAPTSMN1; SMN2LMNAPOLBTP53
SCHEMBL6797565 0.82 MAPT (0.78) CDC25BMAPTSMN1; SMN2LMNAPOLB
SCHEMBL6792401 0.81 ROCK1 (0.53) MAPTSMN1; SMN2LMNATP53KDM4E
SCHEMBL6798215 0.81 CDC25B (0.57) CDC25BLMNANPC1RAB9AKDM4E
SCHEMBL2496522 0.81 SMN1; SMN2 (0.67) CDC25BMAPTSMN1; SMN2LMNAPOLB
SCHEMBL12136818 0.80 CDC25B (0.80) CDC25BMAPTSMN1; SMN2LMNAPOLB
SCHEMBL23518343 0.79 MAPT (0.65) CDC25BMAPTSMN1; SMN2LMNAPOLB
SCHEMBL7446183 0.79 HTT (0.55) MAPTSMN1; SMN2LMNAPOLBBRAF

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 10 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
CN-1051548-C Heterobicyclic derivatives, pharmaceutical compositions containing them, process for preparing them and their use FUJISAWA PHARMACEUTICAL CO (JP) 2000-04-19 CN disclosed
CN-1250776-A Heterodicyclic compound derivatives FUJISAWA PHARMACEUTICAL CO (JP) 2000-04-19 CN 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
CN-1157617-A Heterobicyclic derivatives FUJISAWA PHARMACEUTICAL CO (JP) 1997-08-20 CN disclosed
EP-0770079-A1 HETEROBICYCLIC DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-05-02 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 CDC25B 3105/4885MAPT 4677/4885SMN1; SMN2 3337/4885

“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.