SCHEMBL6798734

SCHEMBL6798734

Nc1cccnc1Nc1cccc(C(=O)Nc2cc(Cl)cc(Cl)c2)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM4 Q14833 2/20 0.55
FADS1 O60427 1/20 0.49
CES1 P23141 1/20 0.47
MEN1 O00255 5/20 0.47
KMT2A Q03164 5/20 0.47
KDR P35968 1/20 0.47
RAB9A P51151 2/20 0.46
NPC1 O15118 2/20 0.46
LMNA P02545 2/20 0.46
MAPT P10636 2/20 0.46
HTT P42858 2/20 0.46
NPSR1 Q6W5P4 1/20 0.46
SENP8 Q96LD8 1/20 0.46
SENP7 Q9BQF6 1/20 0.46
SENP6 Q9GZR1 1/20 0.46
HPGD P15428 1/20 0.46
USP2 O75604 1/20 0.46
HDAC6 Q9UBN7 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
ALDH1A1 P00352 1/20 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
SCHEMBL7830229 0.89 GRM4 (0.56) GRM4CES1MEN1KMT2AKDR
SCHEMBL6791845 0.83 KCNK3 (0.61) GRM4MEN1KMT2AKDRMAPT
SCHEMBL6795362 0.82 DHODH (0.52) MEN1KMT2ARAB9ANPC1LMNA
SCHEMBL6799275 0.80 ALDH1A1 (0.41) GRM4MEN1KMT2AKDRRAB9A
SCHEMBL6798215 0.80 CDC25B (0.57) MEN1KMT2ARAB9ANPC1LMNA
SCHEMBL6798812 0.79 NPC1 (0.63) GRM4FADS1RAB9ANPC1HTT
SCHEMBL6797018 0.79 MEN1 (0.51) MEN1KMT2ARAB9ANPC1LMNA
SCHEMBL6799252 0.78 MEN1 (0.54) MEN1KMT2AKDRRAB9ANPC1
SCHEMBL6797593 0.78 DHODH (0.54) MEN1KMT2ARAB9ANPC1LMNA
SCHEMBL6795629 0.77 NPSR1 (0.63) FADS1MEN1KMT2ARAB9ANPC1

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 7 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
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 GRM4 2633/4885FADS1 294/4885CES1 260/4885

“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.