SCHEMBL26634673

SCHEMBL26634673

C=CCc1ccc(CCC(=O)O)c(O)c1C(C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR1H4 Q96RI1 1/20 0.39
▸ POLB P06746 2/20 0.38
▸ NPSR1 Q6W5P4 2/20 0.37
▸ FFAR1 O14842 4/20 0.35
▸ FFAR4 Q5NUL3 2/20 0.35
▸ GABRA1 P14867 1/20 0.35
▸ GABRB2 P47870 1/20 0.35
▸ RXRA P19793 1/20 0.35
▸ RXRB P28702 1/20 0.35
▸ RXRG P48443 1/20 0.35
▸ KDM4E B2RXH2 2/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ HSD17B10 Q99714 2/20 0.35
▸ HPGD P15428 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ PPARA Q07869 1/20 0.34
▸ MAPT P10636 1/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ ELANE P08246 1/20 0.33
▸ MAPK1 P28482 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
SCHEMBL8520513 0.85 POLB (0.42) NR1H4POLBNPSR1FFAR1FFAR4
SCHEMBL2163934 0.82 POLB (0.42) NR1H4POLBNPSR1FFAR1FFAR4
SCHEMBL10413004 0.78 GABRA1 (0.43) POLBGABRA1GABRB2ELANE
SCHEMBL6611287 0.76 NPSR1 (0.49) NR1H4POLBNPSR1FFAR1FFAR4
SCHEMBL7882529 0.75 NR1H4 (0.43) NR1H4POLBNPSR1FFAR1FFAR4
SCHEMBL6555050 0.75 GAA (0.48) NPSR1RXRARXRBRXRGALDH1A1
SCHEMBL3673064 0.73 NPSR1 (0.44) NR1H4POLBNPSR1FFAR4GABRA1
SCHEMBL30337061 0.72 POLB (0.47) NR1H4POLBNPSR1FFAR1FFAR4
SCHEMBL55627 0.72 POLB (0.47) NR1H4POLBNPSR1FFAR1FFAR4
SCHEMBL89135 0.72 PKM (0.38) NPSR1KDM4EALDH1A1HSD17B10HPGD

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
US-20230357551-A1 RUBBER PROCESS OIL AND RUBBER COMPOSITION INCLUDING SAME DL CHEMICAL CO., LTD. (KR) 2023-11-09 — — US claimed
CN-117004238-A Rubber processing oil and rubber composition containing the same DL化学株式会社 2023-11-07 — — CN claimed
US-20230357551-A1 RUBBER PROCESS OIL AND RUBBER COMPOSITION INCLUDING SAME DL CHEMICAL CO., LTD. (KR) 2023-11-09 — — US disclosed
CN-117004238-A Rubber processing oil and rubber composition containing the same DL化学株式会社 2023-11-07 — — CN disclosed
Send feedback