SCHEMBL4897470

SCHEMBL4897470

C=COC(=O)C1CC1.O=C(O)C1=CCC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.44
LMNA P02545 2/20 0.44
CES2 O00748 1/20 0.34
GABRP O00591 1/20 0.33
GABRD O14764 1/20 0.33
GABRA1 P14867 1/20 0.33
GABRB1 P18505 1/20 0.33
GABRG2 P18507 1/20 0.33
GABRR1 P24046 1/20 0.33
GABRB3 P28472 1/20 0.33
GABRA5 P31644 1/20 0.33
GABRA3 P34903 1/20 0.33
GABRA2 P47869 1/20 0.33
GABRB2 P47870 1/20 0.33
GABRA4 P48169 1/20 0.33
GABRE P78334 1/20 0.33
GABRA6 Q16445 1/20 0.33
GABRG1 Q8N1C3 1/20 0.33
GABRG3 Q99928 1/20 0.33
GABRQ Q9UN88 1/20 0.33

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
SCHEMBL5528 0.78
SCHEMBL295509 0.78 KMT2A (0.41)
SCHEMBL5668348 0.78 TSHR (0.40) TSHRLMNACES2GABRPGABRD
SCHEMBL7777829 0.78 TSHR (0.35) TSHRLMNACES2GABRPGABRD
Terephthalic Acid SCHEMBL3099452 0.78 TSHR (0.43) TSHRLMNACES2ELANE
Hydrochloric Acid SCHEMBL10608471 0.76
Formaldehyde SCHEMBL9633220 0.76 KMT2A (0.40)
Charcoal, Activated SCHEMBL8216968 0.76
Water SCHEMBL9815377 0.76
Acrylic Acid SCHEMBL20490 0.75 LMNA (0.43) LMNAELANE

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-20080083062-A1 Hot tub cover protector and method of using the same CHASE KEVIN 2008-04-10 US disclosed