SCHEMBL17259074

SCHEMBL17259074

OC(=S)CCCCCCCCCCC(O)=S

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 5/20 0.41
▸ LMNA P02545 3/20 0.41
▸ NFKB1 P19838 1/20 0.41
▸ PMP22 Q01453 1/20 0.41
▸ GPR84 Q9NQS5 7/20 0.33
▸ CES2 O00748 3/20 0.33
▸ CES1 P23141 3/20 0.33
▸ FFAR1 O14842 2/20 0.33
▸ FFAR4 Q5NUL3 2/20 0.33
▸ PPARG P37231 6/20 0.32
▸ PPARD Q03181 6/20 0.32
▸ PPARA Q07869 6/20 0.32
▸ HDAC11 Q96DB2 5/20 0.32
▸ ALDH1A1 P00352 3/20 0.32
▸ TLR2 O60603 2/20 0.32
▸ TDP1 Q9NUW8 2/20 0.32
▸ MEN1 O00255 2/20 0.32
▸ FABP4 P15090 2/20 0.32
▸ ALOX15 P16050 2/20 0.32
▸ PTPN1 P18031 2/20 0.32

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
SCHEMBL2786441 1.00 TSHR (0.41) TSHRLMNANFKB1PMP22GPR84
SCHEMBL7712357 1.00 TSHR (0.41) TSHRLMNANFKB1PMP22GPR84
SCHEMBL2336676 1.00 TSHR (0.41) TSHRLMNANFKB1PMP22GPR84
SCHEMBL7712167 1.00 TSHR (0.41) TSHRLMNANFKB1PMP22GPR84
SCHEMBL2026151 0.96 LMNA (0.38) TSHRLMNANFKB1PMP22CES2
SCHEMBL8781415 0.87 — —
SCHEMBL3777730 0.84 CES2 (0.57) TSHRGPR84CES2CES1FFAR1
SCHEMBL422550 0.84 TSHR (0.33) TSHRLMNANFKB1PMP22
SCHEMBL7749105 0.84 CES2 (0.57) TSHRGPR84CES2CES1FFAR1
SCHEMBL7743611 0.84 CES2 (0.57) TSHRGPR84CES2CES1FFAR1

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-9593234-B2 Rubber composition having intramolecular double bond THE YOKOHAMA RUBBER CO., LTD. (JP) 2017-03-14 — — US claimed
US-20150329708-A1 RUBBER COMPOSITION HAVING INTRAMOLECULAR DOUBLE BOND THE YOKOHAMA RUBBER CO., LTD. (JP) 2015-11-19 — — US claimed
US-9593234-B2 Rubber composition having intramolecular double bond THE YOKOHAMA RUBBER CO., LTD. (JP) 2017-03-14 — — US disclosed
US-20150329708-A1 RUBBER COMPOSITION HAVING INTRAMOLECULAR DOUBLE BOND THE YOKOHAMA RUBBER CO., LTD. (JP) 2015-11-19 — — US disclosed
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