SCHEMBL11038204

SCHEMBL11038204

CCCCCC1=Nc2cnc3ccccc3c2N(C(C)=O)N1C(C)=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TLR7 Q9NYK1 5/20 0.41
▸ BCHE P06276 2/20 0.40
▸ LMNA P02545 2/20 0.38
▸ PDE4A P27815 1/20 0.37
▸ PDE4B Q07343 1/20 0.37
▸ PDE4C Q08493 1/20 0.37
▸ PDE4D Q08499 1/20 0.37
▸ ATM Q13315 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ TRPV1 Q8NER1 5/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ USP2 O75604 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ GLA P06280 1/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ CASP1 P29466 1/20 0.35

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
SCHEMBL11038226 0.99 TLR7 (0.42) TLR7BCHELMNAPDE4APDE4B
SCHEMBL11038236 0.97 BCHE (0.39) TLR7BCHELMNAPDE4APDE4B
SCHEMBL11257731 0.94 TLR7 (0.38) TLR7BCHELMNAPDE4APDE4B
SCHEMBL11252296 0.85 BCHE (0.39) BCHEKDM4E
SCHEMBL11040963 0.84 USP5 (0.33) TLR7BCHELMNASMN1; SMN2TSHR
SCHEMBL11248849 0.81 BCHE (0.38) BCHE
SCHEMBL11040110 0.81 USP5 (0.34) BCHESMN1; SMN2TSHRKDM4EALDH1A1
SCHEMBL11038010 0.78 TLR7 (0.42) TLR7BCHELMNAPDE4APDE4B
SCHEMBL11057991 0.78 ALDH1A1 (0.34) BCHEPDE4APDE4BPDE4CPDE4D
Hydrochloric Acid SCHEMBL11036610 0.77 TLR7 (0.41) TLR7BCHELMNAPDE4APDE4B

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-0038528-B1 DIHYDRO-AS-TRIAZINO(5,6-C)QUINOLINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THESE COMPOUNDS EGYT GYOGYSZERVEGYESZETI GYAR (HU) 1984-08-08 — — EP disclosed
US-4342766-A SAID COMPOUNDS POSSESS ANTIPHLOGISTIC, ANALGESIC, ANTICONVULSIVE AND TRANQUILIZING PROPERTIES EGYT GYOGYSZERVEGYESZETI GYAR (HU) 1982-08-03 — — US disclosed
EP-0038528-A1 Dihydro-as-triazino(5,6-c)quinoline derivatives, process for their preparation and pharmaceutical compositions containing these compounds EGYT GYOGYSZERVEGYESZETI GYAR (HU) 1981-10-28 — — EP disclosed
Send feedback