SCHEMBL14844978

SCHEMBL14844978

CC(=O)Oc1cccc(-c2ccncn2)c1C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 1/20 0.46
▸ POLB P06746 1/20 0.43
▸ PDE5A O76074 1/20 0.39
▸ PTPN1 P18031 1/20 0.39
▸ KDM4E B2RXH2 5/20 0.38
▸ TDP1 Q9NUW8 2/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ ALOX12 P18054 1/20 0.38
▸ KDR P35968 3/20 0.38
▸ TEK Q02763 3/20 0.38
▸ HSD17B10 Q99714 3/20 0.38
▸ TTR P02766 2/20 0.38
▸ MAPK1 P28482 2/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ HPGD P15428 2/20 0.38
▸ LMNA P02545 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ ABCC4 O15439 1/20 0.38
▸ USP2 O75604 1/20 0.38

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
SCHEMBL14844977 0.82 PTPN1 (0.46) ACHEPOLBPTPN1KDM4ETDP1
SCHEMBL12485236 0.81 KMT2A (0.45) POLBKDM4ESMN1; SMN2MEN1HTR2A
SCHEMBL12483487 0.81 ACHE (0.49) ACHEPOLBPDE5APTPN1KDM4E
SCHEMBL14844839 0.80 POLM (0.49) POLBKDM4EMEN1HTR2AKMT2A
SCHEMBL12484604 0.80 POLM (0.51) KDM4EMEN1HTR2AKMT2A
SCHEMBL12483491 0.78 ACHE (0.46) ACHEPOLBPDE5APTPN1KDM4E
SCHEMBL27732755 0.74 NUDT1 (0.40) TDP1CYP3A4KDRTEKHSD17B10
SCHEMBL544041 0.73 ACHE (0.69) ACHEPOLBPTPN1KDM4ETDP1
SCHEMBL27913277 0.72 AAK1 (0.40) CYP3A4KDRTEKHSP90AA1CHRNA4
SCHEMBL28308750 0.72 CYP2D6 (0.39) KDRTEK

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-2763995-A1 CBP/CATENIN ANTAGONISTS FOR ENHANCING ASYMMETRIC DIVISION OF SOMATIC STEM CELLS University of Southern California (US) 2014-08-13 — — EP disclosed
WO-2013052162-A1 CBP/CATENIN ANTAGONISTS FOR ENHANCING ASYMMETRIC DIVISION OF SOMATIC STEM CELLS UNIVERSITY OF SOUTHERN CALIFORNIA (US) 2013-04-11 — — WO disclosed
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