SCHEMBL19840311

SCHEMBL19840311

Cc1ccc(/C=C2\CN(S(=O)(=O)c3ccc(C)cc3)C/C(=C\c3ccc(C)cc3)C2=O)cc1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 4/20 0.54
▸ KMT2A Q03164 4/20 0.54
▸ CYP1A2 P05177 1/20 0.54
▸ ACHE P22303 3/20 0.54
▸ PKM P14618 3/20 0.51
▸ HTT P42858 2/20 0.50
▸ MMP2 P08253 1/20 0.50
▸ ALDH1A1 P00352 1/20 0.50
▸ POLB P06746 1/20 0.50
▸ GAA P10253 2/20 0.46
▸ TSHR P16473 1/20 0.46
▸ CYP2C19 P33261 1/20 0.46
▸ HDAC1 Q13547 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ LMNA P02545 1/20 0.45

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
SCHEMBL16755573 1.00 MEN1 (0.54) MEN1KMT2ACYP1A2ACHEPKM
SCHEMBL15561391 1.00 MEN1 (0.54) MEN1KMT2ACYP1A2ACHEPKM
SCHEMBL16769871 0.93 GPR183 (0.52) MEN1KMT2ACYP1A2ACHEPKM
SCHEMBL19840310 0.93 DRD3 (0.50) MEN1KMT2ACYP1A2ACHEPKM
SCHEMBL16755567 0.93 ACHE (0.48) MEN1KMT2ACYP1A2ACHEPKM
SCHEMBL15562263 0.93 GPR183 (0.52) MEN1KMT2ACYP1A2ACHEPKM
SCHEMBL19840309 0.93 ACHE (0.48) MEN1KMT2ACYP1A2ACHEPKM
SCHEMBL15562261 0.93 GPR183 (0.52) MEN1KMT2ACYP1A2ACHEPKM
SCHEMBL16755523 0.93 DRD3 (0.50) MEN1KMT2ACYP1A2ACHEPKM
SCHEMBL16755569 0.93 ACHE (0.48) MEN1KMT2ACYP1A2ACHEPKM

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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