SCHEMBL8388252

SCHEMBL8388252

CCN(c1cccc(C)c1)C(C)S(=O)(=O)O.[KH]

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.48
MAPT P10636 1/20 0.48
ALDH1A1 P00352 4/20 0.41
HPGD P15428 3/20 0.41
HSD17B10 Q99714 2/20 0.41
ALOX15 P16050 1/20 0.41
HTT P42858 1/20 0.40
POLB P06746 3/20 0.40
GLA P06280 2/20 0.39
TDP1 Q9NUW8 1/20 0.39
LMNA P02545 2/20 0.38
NPC1 O15118 1/20 0.38
PER2 O15055 1/20 0.38
CRY1 Q16526 1/20 0.38
CRY2 Q49AN0 1/20 0.38
POLQ O75417 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
RECQL P46063 1/20 0.37
HCRTR2 O43614 1/20 0.37

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
SCHEMBL9314947 0.98 TP53 (0.49) TP53MAPTALDH1A1HPGDHSD17B10
SCHEMBL10797166 0.84 TAAR1 (0.45) MAPTALDH1A1HTTTDP1LMNA
SCHEMBL7959682 0.83 MAPT (0.46) TP53MAPTALDH1A1HPGDHSD17B10
SCHEMBL186732 0.82 TP53 (0.48) TP53MAPTALDH1A1HPGDHSD17B10
SCHEMBL10663663 0.82 RAB9A (0.50) TP53MAPTALDH1A1HTTPOLB
SCHEMBL6845542 0.81 TP53 (0.47) TP53MAPTALDH1A1HPGDHSD17B10
SCHEMBL9762186 0.81 TP53 (0.46) TP53MAPTALDH1A1HSD17B10GLA
SCHEMBL9081406 0.80 TP53 (0.46) TP53MAPTALDH1A1HPGDHSD17B10
SCHEMBL11350458 0.80 TP53 (0.46) TP53MAPTALDH1A1HPGDHSD17B10
SCHEMBL10660448 0.80 RAB9A (0.42) TP53MAPTALDH1A1HTTGLA

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-5916759-A AMINO ACID SEQUENCE WITHOUT SPECIES SIGNAL SEQUENCE INCREASES YIELD IN GENETICALLY ENGINEERED EXPRESSION SYSTEMS; FOR DETERMINATION OF CHOLESTEROL IN SAMPLES BOEHRINGER MANNHEIM GMBH (DE) 1999-06-29 US disclosed