SCHEMBL11670526

SCHEMBL11670526

CCN(CC(=O)c1cc(C)ccc1C)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 6/20 0.51
▸ KMT2A Q03164 6/20 0.51
▸ TSHR P16473 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.42
▸ PKM P14618 1/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ MAPT P10636 3/20 0.41
▸ NPC1 O15118 2/20 0.41
▸ RAB9A P51151 2/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ CYP2D6 P10635 1/20 0.41
▸ POLB P06746 2/20 0.40
▸ CNR2 P34972 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ NOX1 Q9Y5S8 1/20 0.40

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
SCHEMBL11670616 0.89 HSD11B1 (0.51) MEN1KMT2ATDP1MAPTNPC1
SCHEMBL11671426 0.87 MEN1 (0.47) MEN1KMT2ATSHRALDH1A1MAPT
SCHEMBL11670952 0.85 MEN1 (0.43) MEN1KMT2ATSHRALDH1A1MAPT
SCHEMBL11671088 0.85 HSD11B1 (0.43) MEN1KMT2ATSHRTDP1ALDH1A1
SCHEMBL11671130 0.83 LMNA (0.47) MEN1KMT2AALDH1A1MAPTNPC1
SCHEMBL11672341 0.82 MEN1 (0.54) MEN1KMT2ATSHRTDP1ALDH1A1
SCHEMBL11671134 0.81 MEN1 (0.41) MEN1KMT2ATSHRTDP1ALDH1A1
SCHEMBL11670784 0.79 KMT2A (0.54) MEN1KMT2ATSHRALDH1A1MAPT
SCHEMBL11671054 0.78 CES2 (0.49) MEN1KMT2ATDP1ALDH1A1MAPT
SCHEMBL11670703 0.75 ALDH1A1 (0.53) MEN1KMT2ATSHRTDP1ALDH1A1

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
US-4039526-A PRINTING, POLYACRYLONITRILE, POLYESTERS, POLYAMIDES BAYER AKTIENGESELLSCHAFT (DT) 1977-08-02 — — US disclosed
US-4039539-A 1,2,4-Triazole-azo-aniline cationic dyestuffs BAYER AKTIENGESELLSCHAFT (DT) 1977-08-02 — — US disclosed
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