SCHEMBL26855588

SCHEMBL26855588

CO/N=C1\c2cc(C(=O)NCCN)ccc2-n2c1nc1cc(Cl)ccc1c2=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.44
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ IDO1 P14902 3/20 0.40
▸ EGFR P00533 1/20 0.40
▸ CYP1A2 P05177 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ NFKB1 P19838 1/20 0.39
▸ MAOB P27338 1/20 0.39
▸ APAF1 O14727 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ CSNK2A2 P19784 1/20 0.39
▸ CLK2 P49760 1/20 0.39
▸ CSNK2B P67870 1/20 0.39
▸ CSNK2A1 P68400 1/20 0.39
▸ CSNK2A3 Q8NEV1 1/20 0.39
▸ TERT O14746 2/20 0.39

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
SCHEMBL26855341 0.90 MEN1 (0.43) POLBMEN1KMT2AIDO1EGFR
SCHEMBL26855333 0.88 POLB (0.41) POLBMEN1KMT2AIDO1EGFR
SCHEMBL26614146 0.86 APAF1 (0.53) MEN1KMT2AIDO1EGFRCYP1A2
SCHEMBL26855589 0.80 POLB (0.41) POLBMEN1KMT2AEGFRAPAF1
SCHEMBL26614232 0.78 APAF1 (0.57) POLBMEN1KMT2AIDO1EGFR
SCHEMBL26855091 0.77 APAF1 (0.46) POLBMEN1KMT2AIDO1EGFR
SCHEMBL26855331 0.76 KMT2A (0.49) MEN1KMT2AIDO1EGFRAPAF1
SCHEMBL30639057 0.76 APAF1 (0.50) POLBMEN1KMT2AIDO1EGFR
SCHEMBL26614211 0.76 APAF1 (0.50) POLBMEN1KMT2AIDO1EGFR
SCHEMBL30639088 0.76 APAF1 (0.48) POLBMEN1KMT2AIDO1EGFR

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-2023211977-A1 TRYPTANTHRIN DERIVATIVES AND USES THEREOF VISCIENT BIO, INC. (US) 2023-11-02 — — WO disclosed
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