SCHEMBL7782007

SCHEMBL7782007

CCCCCCCC(C)N(C(C)O)C(C)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SPHK1 Q9NYA1 2/20 0.48
GPR84 Q9NQS5 5/20 0.43
FFAR1 O14842 1/20 0.43
LMNA P02545 2/20 0.43
OPRM1 P35372 1/20 0.41
CYP2D6 P10635 2/20 0.41
ADH1B P00325 1/20 0.41
ADH1C P00326 1/20 0.41
ADH1A P07327 1/20 0.41
ADH4 P08319 1/20 0.41
ADH7 P40394 1/20 0.41
GMNN O75496 1/20 0.41
POLB P06746 1/20 0.41
THPO P40225 1/20 0.41
MTOR P42345 1/20 0.41
BLM P54132 1/20 0.41
KDM4E B2RXH2 1/20 0.41
TP53 P04637 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41

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
SCHEMBL429598 1.00 SPHK1 (0.48) SPHK1GPR84FFAR1LMNAOPRM1
Hydrochloric Acid SCHEMBL25291227 0.98 SPHK1 (0.47) SPHK1GPR84FFAR1LMNACYP2D6
SCHEMBL372660 0.85 OPRM1 (0.48) SPHK1LMNAOPRM1ADH1BADH1C
SCHEMBL372503 0.85 OPRM1 (0.48) SPHK1LMNAOPRM1ADH1BADH1C
SCHEMBL372446 0.85 OPRM1 (0.48) SPHK1LMNAOPRM1ADH1BADH1C
SCHEMBL372363 0.85 OPRM1 (0.48) SPHK1LMNAOPRM1ADH1BADH1C
Hydrochloric Acid SCHEMBL6234785 0.83 OPRM1 (0.46) SPHK1LMNAOPRM1ADH1BADH1C
Bromide SCHEMBL11336578 0.83 OPRM1 (0.46) SPHK1LMNAOPRM1ADH1BADH1C
Bromide SCHEMBL11332379 0.83 OPRM1 (0.46) SPHK1LMNAOPRM1ADH1BADH1C
Water SCHEMBL11794021 0.83 OPRM1 (0.46) SPHK1LMNAOPRM1ADH1BADH1C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0953673-B1 Agents for and methods of processing synthetic fibers TAKEMOTO OIL & FAT CO LTD (JP) 2001-10-10 EP disclosed
US-6143038-A STRAIGHT-CHAIN POLYETHER MODIFIED POLYORGANOSILOXANE OF A SPECIFIED KIND AND AN IONIC SURFACTANT AT SPECIFIED RATIOS ARE APPLIED AT A SPECIFIED RATE TO SYNTHETIC FIBERS SUBJECTED TO A HEAT TREATMENT SUCH AS FALSE TWISTING TAKEMOTO YUSHI KABUSHIKI KAISHA (JP) 2000-11-07 US disclosed
EP-0953673-A2 Agents for and methods of processing synthetic fibers Takemoto Yushi Kabushiki Kaisha (JP) 1999-11-03 EP disclosed