SCHEMBL1159982

SCHEMBL1159982

CCCCCCCCCCCCOP(OCCCCCCCCCCCC)Oc1ccc(C(C)(C)c2ccc(OP(OCCCCCCCCCCCC)OCCCCCCCCCCCC)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NR5A1 Q13285 1/20 0.40
S1PR1 P21453 1/20 0.37
TP53 P04637 2/20 0.36
TSHR P16473 1/20 0.36
LTA4H P09960 3/20 0.36
PLA2G4B P0C869 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
RARB P10826 3/20 0.34
CNR2 P34972 1/20 0.34
PSMB1 P20618 1/20 0.34
PSMB5 P28074 1/20 0.34
PSMB2 P49721 1/20 0.34
NPC1 O15118 1/20 0.34
LMNA P02545 1/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
ALOX15 P16050 1/20 0.34
RAB9A P51151 1/20 0.34
HSD17B10 Q99714 1/20 0.34

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
SCHEMBL6742945 1.00 NR5A1 (0.40) NR5A1S1PR1TP53TSHRLTA4H
SCHEMBL30172497 0.94 SMN1; SMN2 (0.44) LTA4HSMN1; SMN2LMNAGAA
SCHEMBL5704362 0.93 NR5A1 (0.53) NR5A1S1PR1TP53TSHRLTA4H
SCHEMBL2885487 0.93 NR5A1 (0.53) NR5A1S1PR1TP53TSHRLTA4H
SCHEMBL5479663 0.93 NR5A1 (0.53) NR5A1S1PR1TP53TSHRLTA4H
SCHEMBL18496995 0.91 SMN1; SMN2 (0.44) LTA4HSMN1; SMN2LMNAGAA
SCHEMBL12997310 0.91 HRH3 (0.40) NR5A1S1PR1TP53TSHRLTA4H
SCHEMBL11638026 0.91 HRH3 (0.40) NR5A1S1PR1TP53TSHRLTA4H
SCHEMBL7641671 0.88 HRH3 (0.40) NR5A1S1PR1TP53TSHRLTA4H
SCHEMBL11158970 0.88 HRH3 (0.40) NR5A1S1PR1TP53TSHRLTA4H

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
US-8008383-B2 Liquid amylaryl phosphite compositions CHEMTURA CORPORATION (US) 2011-08-30 US disclosed
US-8008384-B2 Liquid butylaryl phosphite compositions CHEMTURA CORPORATION (US) 2011-08-30 US disclosed
WO-2011014212-A1 LIQUID BUTYLARYL PHOSPHITE COMPOSITIONS CHEMTURA CORPORATION (US) 2011-02-03 WO disclosed
WO-2011014209-A1 LIQUID AMYLARYL PHOSPHITE COMPOSITIONS CHEMTURA CORPORATION (US) 2011-02-03 WO disclosed
US-20100190900-A1 LIQUID BUTYLARYL PHOSPHITE COMPOSITIONS CHEMTURA CORPORATION (US) 2010-07-29 US disclosed
US-20090326112-A1 LIQUID AMYLARYL PHOSPHITE COMPOSITIONS CHEMTURA CORPORATION (US) 2009-12-31 US disclosed