SCHEMBL9601161

SCHEMBL9601161

CCC=C(CCCCCC)C(=O)OCCCC

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.47
DGKA P23743 1/20 0.47
ATM Q13315 1/20 0.44
DNM1 Q05193 1/20 0.44
NAAA Q02083 1/20 0.43
ALDH1A1 P00352 1/20 0.42
HPGD P15428 1/20 0.42
FAAH O00519 2/20 0.41
HCAR2 Q8TDS4 1/20 0.41
RAD52 P43351 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
CES2 O00748 3/20 0.41
CES1 P23141 3/20 0.41
EPHX1 P07099 1/20 0.41

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
SCHEMBL4442294 0.90 DGKA (0.44) TSHRDGKADNM1FAAHCES2
SCHEMBL1681335 0.90 DGKA (0.44) TSHRDGKADNM1FAAHCES2
SCHEMBL11797938 0.90 DGKA (0.44) TSHRDGKADNM1FAAHCES2
SCHEMBL27884984 0.88 TSHR (0.46) TSHRDGKAATMDNM1NAAA
SCHEMBL5143636 0.88 FAAH (0.54) TSHRDGKADNM1ALDH1A1FAAH
SCHEMBL5768191 0.88 FAAH (0.54) TSHRDGKADNM1ALDH1A1FAAH
SCHEMBL28107615 0.86 TSHR (0.50) TSHRDGKAATMDNM1NAAA
SCHEMBL27737078 0.86 TSHR (0.50) TSHRDGKAATMDNM1NAAA
SCHEMBL8468015 0.85 TSHR (0.50) TSHRDGKAATMNAAAFAAH
SCHEMBL6114366 0.85 TSHR (0.50) TSHRDGKAATMNAAAFAAH

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0305454-B1 SPORTING SURFACES A V SYNTEC PTY LTD (AU) 1993-07-21 EP disclosed
US-4897302-A RESILIENCE, DURABILITY; POLYURETHANE; ACRYLIC POLYMER; FIBER REINFORCEMENT A. V. SYNTEC PTY LTD. (AU) 1990-01-30 US disclosed
EP-0305454-A4 SPORTING SURFACES. A V SYNTEC PTY LTD (AU) 1989-06-27 EP disclosed
EP-0305454-A1 SPORTING SURFACES. A V SYNTEC PTY LTD (AU) 1989-03-08 EP disclosed
WO-1988006971-A1 SPORTING SURFACES A.V. SYNTEC PTY. LTD. (AU) 1988-09-22 WO disclosed