SCHEMBL25424830

SCHEMBL25424830

N#Cc1ccc2ccn(Cc3ccc(C(=O)O)s3)c2c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.49
▸ KDM4E B2RXH2 4/20 0.49
▸ TSHR P16473 4/20 0.49
▸ HSD17B10 Q99714 4/20 0.49
▸ HPGD P15428 3/20 0.49
▸ GLA P06280 1/20 0.49
▸ HTT P42858 1/20 0.49
▸ USP2 O75604 2/20 0.46
▸ POLB P06746 2/20 0.46
▸ MEN1 O00255 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ PRMT5 O14744 1/20 0.39
▸ CCR9 P51686 2/20 0.39
▸ APP P05067 2/20 0.37
▸ SNCA P37840 2/20 0.37
▸ BACE1 P56817 1/20 0.36
▸ KMO O15229 2/20 0.36
▸ EPHX2 P34913 1/20 0.35
▸ CDC7 O00311 4/20 0.34
▸ CDK2 P24941 1/20 0.34

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
SCHEMBL25423743 0.89 ALDH1A1 (0.46) ALDH1A1KDM4ETSHRHSD17B10HPGD
SCHEMBL23631673 0.81 FGFR1 (0.43) POLBPRMT5CCR9KMO
SCHEMBL25426443 0.80 ALDH1A1 (0.43) ALDH1A1KDM4ETSHRHSD17B10HPGD
SCHEMBL29208477 0.76 ALDH1A1 (0.40) ALDH1A1KDM4ETSHRHSD17B10HPGD
SCHEMBL30487729 0.75 ALDH1A1 (0.48) ALDH1A1KDM4ETSHRHSD17B10HPGD
SCHEMBL14632407 0.75 ALDH1A1 (0.65) ALDH1A1KDM4ETSHRHSD17B10HPGD
SCHEMBL29208352 0.74 KDM4E (0.38) ALDH1A1KDM4ETSHRHSD17B10HPGD
SCHEMBL23631696 0.74 NTSR1 (0.44) POLB
SCHEMBL29587844 0.72 ALDH1A1 (0.47) ALDH1A1KDM4ETSHRHSD17B10HPGD
SCHEMBL25425808 0.72 ALDH1A1 (0.47) ALDH1A1KDM4ETSHRHSD17B10HPGD

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4204808-A1 TARGET ENGAGEMENT ASSAY FOR RAS PROTEINS Promega Corporation (US) 2023-07-05 — — EP disclosed
CN-116391129-A Target binding assays for RAS proteins 普罗美加公司 2023-07-04 — — CN disclosed
WO-2022047186-A1 TARGET ENGAGEMENT ASSAY FOR RAS PROTEINS PROMEGA CORPORATION (US) 2022-03-03 — — WO disclosed
US-20220064696-A1 TARGET ENGAGEMENT ASSAY FOR RAS PROTEINS PROMEGA CORPORATION (US) 2022-03-03 — — US disclosed
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