SCHEMBL19296591

SCHEMBL19296591

CCCCN(CCO)c1ccc2c(-c3ccccc3S(=O)(=O)O)c3cc/c(=[N+](\CCO)CCCC)cc-3oc2c1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.51
▸ BLM P54132 2/20 0.51
▸ KMT2A Q03164 2/20 0.51
▸ USP2 O75604 1/20 0.51
▸ POLB P06746 1/20 0.51
▸ PPARG P37231 1/20 0.51
▸ RXFP1 Q9HBX9 1/20 0.51
▸ NCOR2 Q9Y618 1/20 0.51
▸ THRB P10828 1/20 0.40
▸ RECQL P46063 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ CHRM1 P11229 2/20 0.40
▸ FPR2 P25090 4/20 0.39
▸ TGM2 P21980 1/20 0.38
▸ AVPR2 P30518 3/20 0.37
▸ P2RY6 Q15077 1/20 0.36
▸ SLC6A4 P31645 3/20 0.35
▸ APLNR P35414 1/20 0.35

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
SCHEMBL19296587 0.89 MEN1 (0.62) MEN1BLMKMT2AUSP2POLB
SCHEMBL18803473 0.85 MEN1 (0.61) MEN1BLMKMT2AUSP2POLB
SCHEMBL24521830 0.85 ABCB1 (0.48) MEN1BLMKMT2AUSP2POLB
SCHEMBL24226778 0.83 MEN1 (0.45) MEN1BLMKMT2AUSP2POLB
SCHEMBL19296594 0.82 MEN1 (0.70) MEN1BLMKMT2AUSP2POLB
SCHEMBL24521887 0.81 MEN1 (0.41) MEN1BLMKMT2AUSP2POLB
SCHEMBL15355553 0.81 USP2 (0.43) MEN1BLMKMT2AUSP2POLB
SCHEMBL13045902 0.81 MEN1 (0.42) MEN1BLMKMT2AUSP2POLB
SCHEMBL19296575 0.81 MEN1 (0.39) MEN1BLMKMT2AUSP2POLB
SCHEMBL15006490 0.80 MEN1 (0.59) MEN1BLMKMT2AUSP2POLB

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-20170248846-A1 COMPOUND, POLYMER, PHOTOSENSITIVE RESIN COMPOSITION, AND COLOR FILTER SAMSUNG SDI CO., LTD. (KR) 2017-08-31 — — US disclosed
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