SCHEMBL9561069

SCHEMBL9561069

NCCCC[C@H](NC(=O)[C@@H](N)CCCCNC(=O)OCCCCCn1cnc2c(O)ncnc21)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CPB1 P15086 1/20 0.40
▸ CPB2 Q96IY4 1/20 0.40
▸ PRMT5 O14744 2/20 0.36
▸ CARM1 Q86X55 2/20 0.36
▸ PRMT1 Q99873 1/20 0.36
▸ WDR77 Q9BQA1 1/20 0.36
▸ PRMT7 Q9NVM4 1/20 0.36
▸ PRKACA P17612 8/20 0.35
▸ ADCY5 O95622 3/20 0.34
▸ ANPEP P15144 1/20 0.34
▸ AKT3 Q9Y243 3/20 0.33
▸ ROCK2 O75116 2/20 0.33
▸ NRP1 O14786 1/20 0.33
▸ GNAI3 P08754 1/20 0.33
▸ GNAO1 P09471 1/20 0.33
▸ GNAI1 P63096 1/20 0.33
▸ FOLH1 Q04609 1/20 0.33

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
SCHEMBL9561462 1.00 CPB1 (0.40) CPB1CPB2PRMT5CARM1PRMT1
SCHEMBL9561486 0.96 PRMT5 (0.39) CPB1CPB2PRMT5CARM1PRMT1
SCHEMBL9561744 0.96 PRMT5 (0.39) CPB1CPB2PRMT5CARM1PRMT1
SCHEMBL9561414 0.92 NPY4R (0.40) CPB1CPB2PRMT5CARM1PRMT1
SCHEMBL9561455 0.87 HPRT1 (0.41) CPB1CPB2
SCHEMBL9561054 0.87 HPRT1 (0.41) CPB1CPB2
SCHEMBL10534213 0.86 NPY4R (0.36) CPB1CPB2PRMT5CARM1PRMT1
SCHEMBL9561734 0.83 HPRT1 (0.41) CPB1CPB2PRMT5CARM1PRMT1
SCHEMBL9561473 0.83 HPRT1 (0.41) CPB1CPB2PRMT5CARM1PRMT1
SCHEMBL10532501 0.83 ADCY5 (0.37) PRMT5CARM1PRMT1WDR77PRMT7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0346460-B1 PURINE DERIVATIVES HAVING PHARMACOLOGICAL ACTION CO PHARMA CORPORATION (IT) 1993-03-10 — — EP claimed
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
EP-0346460-B1 PURINE DERIVATIVES HAVING PHARMACOLOGICAL ACTION CO PHARMA CORPORATION (IT) 1993-03-10 — — EP disclosed
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