SCHEMBL10532501

SCHEMBL10532501

NCCC[C@H](NC(=O)[C@@H](N)CCCN)C(=O)OC(=O)OCCCCCn1cnc2c(O)ncnc21

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ADCY5 O95622 4/20 0.37
▸ MARS1 P56192 2/20 0.32
▸ ADORA2A P29274 2/20 0.32
▸ PRMT5 O14744 2/20 0.31
▸ CARM1 Q86X55 2/20 0.31
▸ PRMT1 Q99873 1/20 0.31
▸ WDR77 Q9BQA1 1/20 0.31
▸ PRMT7 Q9NVM4 1/20 0.31
▸ FGFR1 P11362 1/20 0.30
▸ SLC22A6 Q4U2R8 1/20 0.30
▸ ADCY1 Q08828 1/20 0.30
▸ TRPM2 O94759 1/20 0.30

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
SCHEMBL9561744 0.85 PRMT5 (0.39) ADCY5MARS1PRMT5CARM1PRMT1
SCHEMBL9561486 0.85 PRMT5 (0.39) ADCY5MARS1PRMT5CARM1PRMT1
SCHEMBL9561462 0.83 CPB1 (0.40) ADCY5PRMT5CARM1PRMT1WDR77
SCHEMBL9561069 0.83 CPB1 (0.40) ADCY5PRMT5CARM1PRMT1WDR77
SCHEMBL10534213 0.73 NPY4R (0.36) PRMT5CARM1PRMT1WDR77PRMT7
SCHEMBL10532237 0.71 ADCY5 (0.46) ADCY5ADORA2AFGFR1SLC22A6ADCY1
SCHEMBL9561473 0.71 HPRT1 (0.41) PRMT5CARM1PRMT1WDR77PRMT7
SCHEMBL9561734 0.71 HPRT1 (0.41) PRMT5CARM1PRMT1WDR77PRMT7
Hydrochloric Acid SCHEMBL9561683 0.71 ADCY5 (0.45) ADCY5ADORA2AFGFR1SLC22A6ADCY1
SCHEMBL9561494 0.70 ADCY5 (0.40) ADCY5ADORA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0346460-A1 PURINE DERIVATIVES HAVING PHARMACOLOGICAL ACTION. CO PHARMA CORP SRL (IT) 1989-12-20 — — EP claimed
WO-1989005818-A1 PURINE DERIVATIVES HAVING PHARMACOLOGICAL ACTION CO PHARMA CORPORATION S.R.L. (IT) 1989-06-29 — — WO claimed
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