SCHEMBL14046507

SCHEMBL14046507

CCN(CC)c1ccc2c(-c3c(Cl)cccc3Cl)c3ccc(=[N+](C)C)cc-3oc2c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 7/20 0.55
▸ KMT2A Q03164 7/20 0.55
▸ TDP1 Q9NUW8 5/20 0.55
▸ BLM P54132 2/20 0.55
▸ THRB P10828 1/20 0.55
▸ RECQL P46063 1/20 0.55
▸ USP2 O75604 2/20 0.51
▸ POLB P06746 2/20 0.51
▸ PPARG P37231 1/20 0.51
▸ RXFP1 Q9HBX9 1/20 0.51
▸ NCOR2 Q9Y618 1/20 0.51
▸ ALDH1A1 P00352 8/20 0.46
▸ KDM4E B2RXH2 5/20 0.46
▸ HPGD P15428 4/20 0.46
▸ GLA P06280 4/20 0.46
▸ L3MBTL1 Q9Y468 4/20 0.46
▸ MAPT P10636 4/20 0.46
▸ CYP3A4 P08684 3/20 0.46
▸ CYP1A2 P05177 2/20 0.46
▸ CYP2C9 P11712 2/20 0.46

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
SCHEMBL13932647 0.88 MEN1 (0.71) MEN1KMT2ATDP1BLMTHRB
SCHEMBL14046582 0.85 MEN1 (0.56) MEN1KMT2ATDP1BLMTHRB
SCHEMBL14046504 0.84 MEN1 (0.77) MEN1KMT2ATDP1BLMTHRB
SCHEMBL12259396 0.81 MEN1 (0.43) MEN1KMT2ATDP1BLMTHRB
SCHEMBL21648601 0.78 MEN1 (0.73) MEN1KMT2ATDP1BLMTHRB
SCHEMBL14013308 0.77 MEN1 (0.60) MEN1KMT2ATDP1BLMTHRB
SCHEMBL13932807 0.77 MEN1 (0.64) MEN1KMT2ATDP1BLMTHRB
SCHEMBL14046505 0.76 ABCB1 (0.55) MEN1KMT2ATDP1BLMTHRB
SCHEMBL12410862 0.76 MEN1 (0.64) MEN1KMT2ATDP1BLMTHRB
SCHEMBL18680527 0.76 MEN1 (0.65) MEN1KMT2ATDP1BLMTHRB

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
US-7432298-B2 Fluorescent polymeric materials containing lipid soluble rhodamine dyes APPLIED BIOSYSTEMS INC. (US) 2008-10-07 — — US disclosed
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