SCHEMBL10883715

SCHEMBL10883715

COc1ccc(C[C@H](N)C(=O)N(C(=O)OC(C)(C)C)[C@H]2[C@@H](O)[C@H](n3cnc4c(N)ncnc43)O[C@@H]2C(=O)NC(Cc2ccccc2)C(=O)O)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TRDMT1 O14717 1/20 0.49
▸ CARM1 Q86X55 2/20 0.48
▸ DOT1L Q8TEK3 1/20 0.47
▸ AHCY P23526 2/20 0.46
▸ ATM Q13315 1/20 0.45
▸ SMN1; SMN2 Q16637 3/20 0.45
▸ NPEPPS P55786 2/20 0.45
▸ TP53 P04637 2/20 0.45
▸ CYP3A4 P08684 2/20 0.45
▸ ANPEP P15144 1/20 0.45
▸ LMNA P02545 1/20 0.45
▸ HIF1A Q16665 1/20 0.45
▸ NNMT P40261 1/20 0.44
▸ HTT P42858 1/20 0.44
▸ NPC1 O15118 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ PAX8 Q06710 1/20 0.44
▸ ADORA3 P0DMS8 2/20 0.44
▸ ADORA2A P29274 2/20 0.44
▸ ADORA1 P30542 2/20 0.44

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
SCHEMBL11060597 0.89 TRDMT1 (0.54) TRDMT1CARM1AHCYATMSMN1; SMN2
SCHEMBL10884690 0.88 TRDMT1 (0.49) TRDMT1CARM1DOT1LAHCYATM
SCHEMBL10886849 0.86 TRDMT1 (0.51) TRDMT1CARM1DOT1LAHCYATM
SCHEMBL10884608 0.86 TRDMT1 (0.51) TRDMT1CARM1DOT1LAHCYATM
SCHEMBL11059822 0.85 TRDMT1 (0.57) TRDMT1CARM1DOT1LAHCYATM
SCHEMBL10884370 0.83 SMN1; SMN2 (0.59) TRDMT1CARM1DOT1LAHCYATM
SCHEMBL10886702 0.83 SMN1; SMN2 (0.59) TRDMT1CARM1DOT1LAHCYATM
SCHEMBL10884643 0.83 AHCY (0.59) TRDMT1CARM1DOT1LAHCYATM
SCHEMBL10896379 0.83 AHCY (0.54) TRDMT1CARM1DOT1LAHCYATM
SCHEMBL11198077 0.83 AHCY (0.54) TRDMT1DOT1LAHCYATMADORA3

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-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
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