SCHEMBL5826734

SCHEMBL5826734

CC(CCOC(=O)c1ccc(C(=O)OCCC(C)CC(C)(C)C)c(C(=O)OCCC(C)CC(C)(C)C)c1)CC(C)(C)C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 3/20 0.50
ALDH1A1 P00352 5/20 0.48
TSHR P16473 5/20 0.48
MAPK1 P28482 2/20 0.48
PKM P14618 2/20 0.40
HSD17B10 Q99714 1/20 0.40
KDM4E B2RXH2 2/20 0.38
GAA P10253 1/20 0.38
KMT2A Q03164 1/20 0.38
RAB9A P51151 1/20 0.36
POLB P06746 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
TDP1 Q9NUW8 2/20 0.35
ESR1 P03372 1/20 0.35
CHRM1 P11229 1/20 0.35
SLC6A2 P23975 1/20 0.35
KDR P35968 1/20 0.35
SERPINE1 P05121 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
MAPT P10636 1/20 0.35

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
SCHEMBL3757630 0.87 MAPK1 (0.50) EGFRALDH1A1TSHRMAPK1PKM
SCHEMBL5826822 0.87 EGFR (0.54) EGFRALDH1A1TSHRMAPK1PKM
SCHEMBL28895855 0.85 EGFR (0.47) EGFRALDH1A1TSHRMAPK1PKM
SCHEMBL2807375 0.84 ALDH1A1 (0.53) EGFRALDH1A1TSHRMAPK1HSD17B10
SCHEMBL29358453 0.84 ALDH1A1 (0.53) EGFRALDH1A1TSHRMAPK1HSD17B10
SCHEMBL19899164 0.83 MAPK1 (0.56) ALDH1A1TSHRMAPK1PKMHSD17B10
SCHEMBL29366621 0.83 MAPK1 (0.56) ALDH1A1TSHRMAPK1PKMHSD17B10
SCHEMBL8615590 0.82 MAPT (0.54) EGFRALDH1A1TSHRMAPK1PKM
SCHEMBL6023299 0.81 SCN1A (0.55) EGFRALDH1A1TSHRMAPK1PKM
SCHEMBL574291 0.80 LMNA (0.54) EGFRALDH1A1TSHRMAPK1PKM

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
US-RE39382-E1 Lubricating oil composition for high-temperature use IDEMITSU KOSAN CO., LTD. (JP) 2006-11-07 US disclosed
EP-1154011-B1 LUBRICATING OIL COMPOSITION FOR HIGH-TEMPERATURE USE IDEMITSU KOSAN CO (JP) 2005-09-14 EP disclosed
US-6465400-B1 THE AMOUNT EVAPORATED IN A THIN FILM AT A HIGH TEMPERATURE IS CONTROLLED AND OF WHICH THE FLUIDITY IS MAINTAINED FOR A LONG PERIOD OF TIME USED IN A CHAIN, A ROLLER CHAIN, A CHAIN CONVEYOR, A BEARING AND THE LIKE IDEMITSU KOSAN CO., LTD. (JP) 2002-10-15 US disclosed
EP-1154011-A9 LUBRICATING OIL COMPOSITION FOR HIGH-TEMPERATURE USE IDEMITSU KOSAN COMPANY LIMITED (JP) 2002-05-15 EP disclosed
EP-1154011-A1 LUBRICATING OIL COMPOSITION FOR HIGH-TEMPERATURE USE IDEMITSU KOSAN COMPANY LIMITED (JP) 2001-11-14 EP disclosed