SCHEMBL14854553

SCHEMBL14854553

c1cc2cc(-c3ccc(-c4cc5ccc(C6=NCCN6)cc5[nH]4)o3)[nH]c2cc1C1=NCCN1

nearest known ligand 0.75

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PRMT1 Q99873 6/20 0.69
▸ PRMT3 O60678 1/20 0.69
▸ EHMT2 Q96KQ7 1/20 0.69
▸ PRMT6 Q96LA8 1/20 0.69
▸ PRMT8 Q9NR22 1/20 0.69
▸ TOP2A P11388 2/20 0.57
▸ TOP2B Q02880 2/20 0.57
▸ ALDH1A1 P00352 1/20 0.52
▸ CYP1A2 P05177 1/20 0.52
▸ HPGD P15428 1/20 0.52
▸ CASP1 P29466 1/20 0.52
▸ CASP7 P55210 1/20 0.52
▸ HSD17B10 Q99714 1/20 0.52

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
SCHEMBL8229714 0.89 PRMT1 (0.71) PRMT1PRMT3EHMT2PRMT6PRMT8
SCHEMBL8238119 0.87 PRMT1 (0.69) PRMT1PRMT3EHMT2PRMT6PRMT8
SCHEMBL362453 0.86 PRMT1 (0.68) PRMT1PRMT3EHMT2PRMT6PRMT8
Hydrochloric Acid SCHEMBL3383477 0.85 PRMT1 (0.66) PRMT1PRMT3EHMT2PRMT6PRMT8
SCHEMBL14535010 0.85 PRMT1 (0.70) PRMT1PRMT3EHMT2PRMT6PRMT8
SCHEMBL14854501 0.83 PRMT1 (0.74) PRMT1PRMT3EHMT2PRMT6PRMT8
SCHEMBL31621368 0.83 PRMT1 (0.66) PRMT1PRMT3EHMT2PRMT6PRMT8
SCHEMBL13204583 0.82 PRMT1 (1.00) PRMT1PRMT3EHMT2PRMT6PRMT8
SCHEMBL15727407 0.81 PRMT1 (0.62) PRMT1PRMT3EHMT2PRMT6PRMT8
SCHEMBL14816979 0.81 PRMT1 (0.65) PRMT1PRMT3EHMT2PRMT6PRMT8

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
WO-2013052263-A2 ANTIFUNGAL COMPOUNDS MICROBIOTIX, INC. (US) 2013-04-11 — — WO disclosed
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