SCHEMBL27010673

SCHEMBL27010673

Cc1ccc2cc(C(C)(C)C)ccc2c1-c1c(O)ccc2cc(C(C)(C)C)ccc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.47
GAA P10253 3/20 0.47
MAPT P10636 2/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
PKM P14618 1/20 0.47
RECQL P46063 1/20 0.47
HPGD P15428 2/20 0.47
HSD17B10 Q99714 2/20 0.47
ALOX15 P16050 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
ESR1 P03372 5/20 0.42
NR1I2 O75469 1/20 0.39
CYP2D6 P10635 5/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
POLB P06746 1/20 0.38
HSP90AA1 P07900 2/20 0.38
HSP90AB1 P08238 2/20 0.38
ESR2 Q92731 4/20 0.37
HSD17B2 P37059 4/20 0.36

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
SCHEMBL7629173 0.92 ALDH1A1 (0.55) ALDH1A1GAAMAPTMEN1KMT2A
SCHEMBL10946476 0.80 ESR1 (0.54) ALDH1A1GAAMAPTMEN1KMT2A
SCHEMBL19196663 0.78 ALDH1A1 (0.55) ALDH1A1GAAMAPTMEN1KMT2A
SCHEMBL11906285 0.76 ALDH1A1 (0.53) ALDH1A1GAAMAPTMEN1KMT2A
SCHEMBL6588363 0.75 ESR1 (0.47) ALDH1A1GAAMAPTMEN1KMT2A
SCHEMBL16978928 0.74 ALDH1A1 (0.46) ALDH1A1GAAMAPTMEN1KMT2A
SCHEMBL5349122 0.74 MEN1 (0.47) MAPTMEN1KMT2AESR1CYP2D6
SCHEMBL24891596 0.74 ESR1 (0.46) ALDH1A1GAAMAPTMEN1KMT2A
SCHEMBL19196115 0.73 ALDH1A1 (0.50) ALDH1A1GAAMAPTMEN1KMT2A
SCHEMBL171132 0.72 ESR1 (0.74) ALDH1A1GAAMAPTMEN1KMT2A

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-20240018439-A1 Lubricating Oil Compositions INFINEUM INTERNATIONAL LIMITED 2024-01-18 US disclosed