SCHEMBL8652181

SCHEMBL8652181

COc1ccc(C(c2ccccc2)(c2ccc(OC)cc2)C(OC(=O)c2ccccc2)(C(=O)c2ccccc2)[C@H]2O[C@@H](n3cnc4c(N)ncnc43)[C@H](O)[C@@H]2O)cc1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PRMT5 O14744 2/20 0.50
▸ WDR77 Q9BQA1 2/20 0.50
▸ ADORA1 P30542 2/20 0.49
▸ AHCY P23526 5/20 0.47
▸ TRDMT1 O14717 1/20 0.47
▸ ADORA3 P0DMS8 1/20 0.46
▸ ADORA2B P29275 1/20 0.46
▸ HIF1A Q16665 1/20 0.46
▸ TMEM97 Q5BJF2 1/20 0.46
▸ SIGMAR1 Q99720 1/20 0.46
▸ CARM1 Q86X55 2/20 0.46
▸ TYMP P19971 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
SCHEMBL5481897 0.82 AHCY (0.57) ADORA1AHCYADORA3ADORA2BHIF1A
SCHEMBL1069001 0.81 PRMT5 (0.55) PRMT5WDR77ADORA1AHCYTRDMT1
SCHEMBL8433551 0.80 ADORA1 (0.51) ADORA1AHCYTRDMT1ADORA3ADORA2B
SCHEMBL5580213 0.76 ADORA1 (0.57) PRMT5WDR77ADORA1AHCYTRDMT1
SCHEMBL8104254 0.75 ADORA1 (0.55) PRMT5WDR77ADORA1AHCYADORA3
SCHEMBL2107506 0.75 ADORA1 (0.53) PRMT5WDR77ADORA1AHCYTRDMT1
SCHEMBL2815316 0.75 ADORA1 (0.49) PRMT5WDR77ADORA1AHCYTRDMT1
SCHEMBL10381791 0.74 ADORA1 (0.60) PRMT5WDR77ADORA1AHCYADORA3
SCHEMBL8359104 0.74 ADORA1 (0.75) ADORA1TRDMT1TYMP
SCHEMBL15993919 0.74 ADORA1 (0.75) ADORA1TRDMT1TYMP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5747326-A Isolated nucleic acid molecules which encode mammalian α2,8 polysialyl transferases LA JOLLA CANCER RESEARCH FOUNDATION (US) 1998-05-05 — — US disclosed
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