SCHEMBL10694740

SCHEMBL10694740

CC(C=CC=CC=Cc1ccsc1)=C(C)C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 2/20 0.40
TAS1R1 Q7RTX1 2/20 0.40
ALOX5 P09917 3/20 0.39
GUSB P08236 1/20 0.39
JAK2 O60674 1/20 0.37
EGFR P00533 1/20 0.37
PPARA Q07869 1/20 0.36
KMT2A Q03164 1/20 0.35
HDAC3 O15379 1/20 0.34
HDAC4 P56524 1/20 0.34
HDAC1 Q13547 1/20 0.34
HDAC7 Q8WUI4 1/20 0.34
HDAC2 Q92769 1/20 0.34
HDAC10 Q969S8 1/20 0.34
HDAC11 Q96DB2 1/20 0.34
HDAC8 Q9BY41 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
HDAC9 Q9UKV0 1/20 0.34
HDAC5 Q9UQL6 1/20 0.34
POLB P06746 2/20 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
SCHEMBL9257838 0.79 GUSB (0.45) TAS1R3TAS1R1ALOX5GUSBJAK2
SCHEMBL9257835 0.79 GUSB (0.45) TAS1R3TAS1R1ALOX5GUSBJAK2
SCHEMBL27788036 0.78 HDAC3 (0.56) ALOX5HDAC3HDAC4HDAC1HDAC7
SCHEMBL10641662 0.78 HDAC3 (0.56) ALOX5HDAC3HDAC4HDAC1HDAC7
SCHEMBL9256654 0.72 GLA (0.53) TAS1R3TAS1R1ALOX5GUSBJAK2
SCHEMBL9256644 0.72 GLA (0.53) TAS1R3TAS1R1ALOX5GUSBJAK2
SCHEMBL9336383 0.71 ALOX5 (0.47) TAS1R3TAS1R1ALOX5GUSBJAK2
SCHEMBL9336376 0.71 ALOX5 (0.47) TAS1R3TAS1R1ALOX5GUSBJAK2
SCHEMBL20539210 0.71 GUSB (0.50) TAS1R3TAS1R1ALOX5GUSBJAK2
SCHEMBL20539212 0.71 GUSB (0.50) TAS1R3TAS1R1ALOX5GUSBJAK2

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
EP-0253393-A2 Methods for treatment of sundamaged human skin with retinoids Kligman, Albert M. (US) 1988-01-20 EP claimed