SCHEMBL7266973

SCHEMBL7266973

CN1C2CCC1CC(n1nnc3ccccc3c1=O)C2

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.49
▸ SMN1; SMN2 Q16637 3/20 0.49
▸ CYP1A2 P05177 1/20 0.49
▸ CYP2C19 P33261 1/20 0.49
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ RAB9A P51151 3/20 0.40
▸ NPC1 O15118 2/20 0.40
▸ GAA P10253 1/20 0.40
▸ ALOX15 P16050 1/20 0.40
▸ HTR3A P46098 1/20 0.40
▸ HPGD P15428 1/20 0.39
▸ MAPK1 P28482 1/20 0.39

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
SCHEMBL7266786 0.82 GPR139 (0.39) CYP2C19MEN1KMT2A
SCHEMBL7276249 0.75 HTR4 (0.39) CYP1A2GAAALOX15HTR3A
SCHEMBL7267551 0.70 HTR4 (0.35) HTR3AMAPK1
SCHEMBL904817 0.70 ALDH1A1 (0.62) ALDH1A1SMN1; SMN2CYP1A2CYP2C19MEN1
SCHEMBL7267544 0.68 PGK1 (0.33) SMN1; SMN2MEN1KMT2AHTR3A
SCHEMBL21751113 0.68 CRBN (0.59) ALDH1A1SMN1; SMN2CYP1A2CYP2C19
SCHEMBL15878936 0.66 ALDH1A1 (0.56) ALDH1A1SMN1; SMN2CYP1A2CYP2C19MEN1
SCHEMBL13831514 0.66 SMN1; SMN2 (1.00) ALDH1A1SMN1; SMN2CYP1A2CYP2C19MEN1
SCHEMBL7436441 0.66 HTR3A (0.50) HTR3A
SCHEMBL14539588 0.65 ALDH1A1 (0.54) ALDH1A1SMN1; SMN2CYP1A2CYP2C19MEN1

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
EP-0315390-B1 Novel 4-oxobenzotriazines and 4-oxoquinazolines BEECHAM GROUP PLC (GB) 1994-07-20 — — EP claimed
US-4959367-A ANALGESICS, TRANQUILIZERS, GASTROINTESTINAL, CNS BEECHAM GROUP P.L.C. (GB) 1990-09-25 — — US claimed
EP-0315390-A2 Novel 4-oxobenzotriazines and 4-oxoquinazolines BEECHAM GROUP PLC (GB) 1989-05-10 — — EP claimed
EP-0315390-B1 Novel 4-oxobenzotriazines and 4-oxoquinazolines BEECHAM GROUP PLC (GB) 1994-07-20 — — EP disclosed
US-4959367-A ANALGESICS, TRANQUILIZERS, GASTROINTESTINAL, CNS BEECHAM GROUP P.L.C. (GB) 1990-09-25 — — US disclosed
EP-0315390-A2 Novel 4-oxobenzotriazines and 4-oxoquinazolines BEECHAM GROUP PLC (GB) 1989-05-10 — — EP disclosed
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