SCHEMBL9511745

SCHEMBL9511745

CCCCCCC(=COC(=O)CC(C)=O)C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HAO1 Q9UJM8 1/20 0.41
THRB P10828 1/20 0.41
FNTA P49354 1/20 0.41
FNTB P49356 1/20 0.41
PGGT1B P53609 1/20 0.41
APEX1 P27695 2/20 0.41
POLB P06746 1/20 0.41
POLA1 P09884 1/20 0.41
GPR84 Q9NQS5 7/20 0.40
PPARG P37231 7/20 0.40
PPARD Q03181 7/20 0.40
PPARA Q07869 7/20 0.40
HDAC11 Q96DB2 5/20 0.40
TSHR P16473 4/20 0.40
PTPN1 P18031 3/20 0.40
ALDH1A1 P00352 2/20 0.40
TLR2 O60603 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
FABP4 P15090 2/20 0.40
PAM P19021 2/20 0.40

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
SCHEMBL9243472 0.94 APEX1 (0.38) HAO1THRBFNTAFNTBPGGT1B
SCHEMBL4402044 0.87 MGAM (0.39) ALDH1A1
SCHEMBL10672201 0.75 GPR84 (0.47) APEX1POLBGPR84PPARGPPARD
SCHEMBL10346678 0.74 TSHR (0.51) GPR84PPARGPPARDPPARAHDAC11
SCHEMBL2088815 0.73 AKR1B1 (0.45) APEX1POLBGPR84PPARGPPARD
SCHEMBL8983190 0.72 MGAM (0.38)
SCHEMBL1623103 0.72 PAM (0.47) THRBFNTAFNTBPGGT1BGPR84
SCHEMBL1622998 0.72 PAM (0.47) THRBFNTAFNTBPGGT1BGPR84
SCHEMBL1622869 0.72 PAM (0.47) THRBFNTAFNTBPGGT1BGPR84
SCHEMBL1623411 0.72 PAM (0.47) THRBFNTAFNTBPGGT1BGPR84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0241127-B1 TEXTILE MATERIALS, METHODS OF MANUFACTURE AND COMPOSITIONS FOR USE THEREIN ROHM AND HAAS COMPANY (US) 1993-10-13 EP disclosed
US-4966791-A BONDING FIBERS WITH POLYMER CONTAINING POLYMERIZED UNSATURATED CARBOXYLIC ESTER MONOMERS AND PENDANT GROUPS WITH TWO CARBONYL OR CARBONYL AND CYANO GROUPS UNION OIL COMPANY OF CALIFORNIA (US) 1990-10-30 US disclosed
US-4900615-A Textile materials and compositions for use therein UNION OIL COMPANY OF CALIFORNIA (US) 1990-02-13 US disclosed
EP-0241127-A2 Textile materials, methods of manufacture and compositions for use therein ROHM AND HAAS COMPANY (US) 1987-10-14 EP disclosed