SCHEMBL19840306

SCHEMBL19840306

CCc1ccc(/C=C2\CN(S(=O)(=O)c3ccc(C)cc3)C/C(=C\c3ccc(CC)cc3)C2=O)cc1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 3/20 0.48
▸ MEN1 O00255 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ CYP1A2 P05177 1/20 0.46
▸ CD4 P01730 2/20 0.44
▸ CARM1 Q86X55 1/20 0.44
▸ PKM P14618 2/20 0.43
▸ ALDH1A1 P00352 2/20 0.42
▸ MMP2 P08253 1/20 0.42
▸ POLB P06746 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ HSD11B1 P28845 1/20 0.42
▸ HDAC1 Q13547 1/20 0.41

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
SCHEMBL16755587 1.00 ACHE (0.48) ACHEMEN1KMT2ACYP1A2CD4
SCHEMBL15561380 1.00 ACHE (0.48) ACHEMEN1KMT2ACYP1A2CD4
SCHEMBL16755573 0.91 MEN1 (0.54) ACHEMEN1KMT2ACYP1A2PKM
SCHEMBL15561391 0.91 MEN1 (0.54) ACHEMEN1KMT2ACYP1A2PKM
SCHEMBL19840311 0.91 MEN1 (0.54) ACHEMEN1KMT2ACYP1A2PKM
SCHEMBL16755539 0.90 ACHE (0.46) ACHEMEN1KMT2ACYP1A2CD4
SCHEMBL16755536 0.90 ACHE (0.46) ACHEMEN1KMT2ACYP1A2CD4
SCHEMBL19840308 0.90 ACHE (0.46) ACHEMEN1KMT2ACYP1A2CD4
SCHEMBL16755580 0.88 HSD11B1 (0.48) ACHEMEN1KMT2APKMALDH1A1
SCHEMBL16769886 0.88 HSD11B1 (0.48) ACHEMEN1KMT2APKMALDH1A1

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-9884825-B2 Curcumin analogs and methods of making and using thereof GEORGIA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) 2018-02-06 — — US disclosed
US-9884825-B2 Curcumin analogs and methods of making and using thereof GEORGIA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) 2018-02-06 — — US disclosed
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