SCHEMBL23867469

SCHEMBL23867469

Cc1cc(Nc2ccc(NC(=O)Cn3cc(CC4CC4)c4ccccc43)cc2)nc(N2CCCC2)n1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CCNE1 P24864 5/20 0.45
▸ CDK2 P24941 5/20 0.45
▸ MAPT P10636 4/20 0.45
▸ THRB P10828 1/20 0.45
▸ RXFP1 Q9HBX9 3/20 0.45
▸ SLC2A1 P11166 1/20 0.43
▸ TP53 P04637 1/20 0.42
▸ MEN1 O00255 4/20 0.42
▸ KMT2A Q03164 4/20 0.42
▸ LMNA P02545 2/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ HTT P42858 1/20 0.42
▸ ALDH1A1 P00352 2/20 0.41
▸ HPGD P15428 2/20 0.41
▸ POLB P06746 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ ALOX15 P16050 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ GFER P55789 1/20 0.41

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
SCHEMBL31094224 0.75 SLC2A1 (0.51) CCNE1CDK2MAPTSLC2A1MEN1
SCHEMBL30234364 0.74 CCNE1 (0.48) CCNE1CDK2MAPTLMNAALDH1A1
SCHEMBL23867526 0.74 CCNE1 (0.48) CCNE1CDK2MAPTLMNAALDH1A1
SCHEMBL23867505 0.73 HTR6 (0.44) CCNE1CDK2MAPTSLC2A1MEN1
SCHEMBL23867649 0.73 ALDH1A1 (0.52) CCNE1CDK2MAPTSLC2A1LMNA
SCHEMBL23867523 0.73 SLC2A1 (0.49) CCNE1CDK2MAPTSLC2A1LMNA
SCHEMBL30979651 0.73 SLC2A1 (0.51) MAPTSLC2A1MEN1KMT2ALMNA
SCHEMBL23867488 0.72 LMNA (0.42) CCNE1CDK2MAPTSLC2A1LMNA
SCHEMBL23859942 0.72 POLB (0.55) MAPTTHRBSLC2A1TP53MEN1
SCHEMBL23867524 0.72 HCRTR1 (0.52) CCNE1CDK2MAPTSLC2A1MEN1

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
WO-2023055763-A2 SMALL MOLECULE INHIBITORS OF ONCOGENIC CHD1L WITH PRECLINICAL ACTIVITY AGAINST COLORECTRAL CANCER THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE (US) 2023-04-06 — — WO disclosed
WO-2021195279-A2 SMALL MOLECULE INHIBITORS OF ONCOGENIC CHD1L WITH PRECLINICAL ACTIVITY AGAINST COLORECTAL CANCER THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE (US) 2021-09-30 — — WO disclosed
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