SCHEMBL10887916

SCHEMBL10887916

COc1ccc(C[C@H](N)C(=O)N(C(=O)CNC(=O)OCc2ccccc2)[C@H]2[C@@H](O)[C@H](n3cnc4c(N)ncnc43)O[C@@H]2C(=O)O)cc1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ AHCY P23526 2/20 0.54
▸ DOT1L Q8TEK3 5/20 0.53
▸ CARM1 Q86X55 2/20 0.49
▸ TRDMT1 O14717 1/20 0.49
▸ ATM Q13315 1/20 0.47
▸ NNMT P40261 1/20 0.47
▸ SMN1; SMN2 Q16637 3/20 0.46
▸ NPEPPS P55786 2/20 0.46
▸ TP53 P04637 2/20 0.46
▸ CYP3A4 P08684 2/20 0.46
▸ ANPEP P15144 1/20 0.46
▸ LMNA P02545 1/20 0.46
▸ HIF1A Q16665 1/20 0.46
▸ HTT P42858 1/20 0.45
▸ NPC1 O15118 1/20 0.45
▸ RAB9A P51151 1/20 0.45
▸ PAX8 Q06710 1/20 0.45
▸ HSP90B1 P14625 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
SCHEMBL10885962 0.91 ADORA2A (0.46) AHCYDOT1LSMN1; SMN2NPEPPSTP53
SCHEMBL10884643 0.91 AHCY (0.59) AHCYDOT1LCARM1TRDMT1ATM
SCHEMBL11059822 0.90 TRDMT1 (0.57) AHCYDOT1LCARM1TRDMT1ATM
SCHEMBL11054057 0.88 TRDMT1 (0.59) AHCYTRDMT1ATMNNMTSMN1; SMN2
SCHEMBL10886529 0.87 TRDMT1 (0.56) AHCYCARM1TRDMT1ATMNNMT
SCHEMBL10896379 0.87 AHCY (0.54) AHCYDOT1LCARM1TRDMT1ATM
SCHEMBL11052640 0.85 AHCY (0.60) AHCYDOT1LTRDMT1ATMNNMT
SCHEMBL10885247 0.85 AHCY (0.65) AHCYDOT1LHIF1AHSP90B1
SCHEMBL10887158 0.85 AHCY (0.65) AHCYDOT1LHIF1AHSP90B1
SCHEMBL10884690 0.84 TRDMT1 (0.49) AHCYDOT1LCARM1TRDMT1ATM

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-0071926-B1 NEW RIBOFURANURONIC ACID DERIVATIVES, PROCESSES FOR PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-10-08 — — EP disclosed
US-4479942-A Tetrahydrofurnancarboxylic acid derivatives, processes for preparation thereof and pharmaceutical compositions thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1984-10-30 — — US disclosed
EP-0071926-A1 New ribofuranuronic acid derivatives, processes for preparation thereof and pharmaceutical compositions thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1983-02-16 — — EP disclosed
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