SCHEMBL8609367

SCHEMBL8609367

CCCCCCCCCCOC(=O)c1ccccc1C(=O)OCCCCC

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 1.00
TSHR P16473 6/20 1.00
LMNA P02545 2/20 1.00
CYP3A4 P08684 2/20 0.96
MAPK1 P28482 2/20 0.96
TP53 P04637 1/20 0.96
L3MBTL1 Q9Y468 3/20 0.86
TDP1 Q9NUW8 2/20 0.86
HSD17B10 Q99714 2/20 0.79
KDM4E B2RXH2 2/20 0.79
POLB P06746 1/20 0.79
MAPT P10636 2/20 0.60
PRSS1 P07477 1/20 0.60
PRSS2 P07478 1/20 0.60
PRSS3 P35030 1/20 0.60
SMN1; SMN2 Q16637 1/20 0.60
NPC1 O15118 1/20 0.58
RAB9A P51151 1/20 0.58

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
SCHEMBL3212303 1.00 ALDH1A1 (1.00) ALDH1A1TSHRLMNACYP3A4MAPK1
SCHEMBL14891680 1.00 ALDH1A1 (1.00) ALDH1A1TSHRLMNACYP3A4MAPK1
SCHEMBL81945 1.00 ALDH1A1 (1.00) ALDH1A1TSHRLMNACYP3A4MAPK1
SCHEMBL6245568 1.00 ALDH1A1 (1.00) ALDH1A1TSHRLMNACYP3A4MAPK1
SCHEMBL2472738 1.00 ALDH1A1 (1.00) ALDH1A1TSHRLMNACYP3A4MAPK1
SCHEMBL7185217 1.00 ALDH1A1 (1.00) ALDH1A1TSHRLMNACYP3A4MAPK1
SCHEMBL7219181 1.00 ALDH1A1 (1.00) ALDH1A1TSHRLMNACYP3A4MAPK1
SCHEMBL2527136 1.00 ALDH1A1 (1.00) ALDH1A1TSHRLMNACYP3A4MAPK1
SCHEMBL4210493 1.00 ALDH1A1 (1.00) ALDH1A1TSHRLMNACYP3A4MAPK1
SCHEMBL5072881 1.00 ALDH1A1 (1.00) ALDH1A1TSHRLMNACYP3A4MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0846130-A4 NATURAL RUBBER THREAD WITH LOW NITROSATABLE AMINES ADAM ROGER M (US) 1998-12-30 EP disclosed
EP-0846130-A1 NATURAL RUBBER THREAD WITH LOW NITROSATABLE AMINES Adam, Roger M. (US) 1998-06-10 EP disclosed
US-5753290-A VULCANIZED RUBBER LATEX GLOBE MANUFACTURING CO. (US) 1998-05-19 US disclosed
WO-1997008209-A1 NATURAL RUBBER THREAD WITH LOW NITROSATABLE AMINES ADAM ROGER M (US) 1997-03-06 WO disclosed
US-4229586-A BY OLIGOMERIZATION OF C3 TO C4 OLEFINS THEN FRACTIONATING AND HYDROFORMYLATING AND ESTERIFYING APPROPRIATE FRACTIONS UOP INC. (US) 1980-10-21 US disclosed
US-4209652-A Process for production of motor fuel and phthalate esters or acyclic alcohols UOP INC. (US) 1980-06-24 US disclosed