SCHEMBL9453733

SCHEMBL9453733

Cc1cc2c(cc1C)C(C)(c1ccccc1)CC2(C)C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.39
PLIN1 O60240 1/20 0.39
ALDH1A1 P00352 1/20 0.39
PLIN5 Q00G26 1/20 0.39
ABHD5 Q8WTS1 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
ADRB2 P07550 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
FSHR P23945 2/20 0.37
TP53 P04637 7/20 0.36
ATM Q13315 1/20 0.36
TSHR P16473 1/20 0.35
RXRA P19793 3/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
RXRB P28702 2/20 0.34
RXRG P48443 2/20 0.34
SIGMAR1 Q99720 1/20 0.34
RARA P10276 1/20 0.34

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
SCHEMBL15427803 0.84 FSHR (0.42) MAPTPLIN1ALDH1A1PLIN5ABHD5
SCHEMBL9453763 0.81 CYP2C19 (0.49) ALDH1A1TDP1TSHRRXRARXRB
SCHEMBL503853 0.80 MEN1 (0.46) MAPTPLIN1ALDH1A1PLIN5ABHD5
SCHEMBL29436894 0.80 MEN1 (0.46) MAPTPLIN1ALDH1A1PLIN5ABHD5
Water SCHEMBL27831248 0.79 MEN1 (0.45) MAPTPLIN1ALDH1A1PLIN5ABHD5
SCHEMBL11156140 0.77 NR3C1 (0.40) MAPTPLIN1ALDH1A1PLIN5ABHD5
SCHEMBL21427236 0.77 GABRA1 (0.37) MAPTPLIN1ALDH1A1PLIN5ABHD5
SCHEMBL17931721 0.77 TP53 (0.43) MAPTPLIN1ALDH1A1PLIN5ABHD5
SCHEMBL11165344 0.77 FTO (0.43) MAPTPLIN1ALDH1A1PLIN5ABHD5
SCHEMBL9453716 0.75 CYP2C19 (0.43) MAPTPLIN1ALDH1A1PLIN5ABHD5

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-5210353-A Transarylalkylation AMOCO CORPORATION (US) 1993-05-11 US disclosed