SCHEMBL30306724

SCHEMBL30306724

CC(C)=C1C=Cc2ccccc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 4/20 0.41
▸ ALDH1A1 P00352 4/20 0.41
▸ MEN1 O00255 3/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ MAPT P10636 3/20 0.41
▸ HSD17B10 Q99714 2/20 0.41
▸ ALOX15 P16050 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ BCHE P06276 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ PTPRC P08575 1/20 0.41
▸ THRB P10828 1/20 0.41
▸ PKM P14618 1/20 0.41
▸ IDO1 P14902 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ PTPN1 P18031 1/20 0.41
▸ ACHE P22303 1/20 0.41
▸ CES1 P23141 1/20 0.41
▸ RECQL P46063 1/20 0.41
▸ PTPN22 Q9Y2R2 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
SCHEMBL1436952 1.00 LMNA (0.41) LMNAALDH1A1MEN1KMT2AMAPT
SCHEMBL7640802 0.79 LMNA (0.36) LMNAALDH1A1MEN1KMT2AMAPT
SCHEMBL8661933 0.74 LMNA (0.33) LMNAALDH1A1MEN1KMT2AMAPT
SCHEMBL6280834 0.73 MAPT (0.39) LMNAALDH1A1MEN1KMT2AMAPT
SCHEMBL28295995 0.71 ALDH1A1 (0.41) LMNAALDH1A1MEN1KMT2AMAPT
SCHEMBL8663496 0.70 CYP1A2 (0.31) LMNAALDH1A1MEN1KMT2AMAPT
SCHEMBL3769766 0.70 MEN1 (0.55) LMNAALDH1A1MEN1KMT2AMAPT
SCHEMBL12588777 0.70 ALDH1A1 (0.55) LMNAALDH1A1MEN1KMT2AMAPT
SCHEMBL2797733 0.69 LMNA (0.48) LMNAALDH1A1MEN1KMT2AMAPT
SCHEMBL7790643 0.68 LMNA (0.43) LMNAALDH1A1MEN1KMT2AMAPT

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
CN-115745759-A Methylpropylidene indene sesquiterpene compound extracted from sun-cured tobacco stem bark and preparation method and application thereof 云南民族大学 2023-03-07 — — CN disclosed
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