Undecane

Undecane

SCHEMBL8665406

CCCCCCCCCCC.CCOC(=O)CC(C(=O)OCC)C(CC(=O)O)C(=O)O

nearest known ligand 0.44

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.44
GPR84 Q9NQS5 6/20 0.41
PAM P19021 2/20 0.40
MAPK1 P28482 4/20 0.38
GMNN O75496 3/20 0.38
LMNA P02545 3/20 0.38
MAPT P10636 3/20 0.38
NPSR1 Q6W5P4 3/20 0.38
CYP1A2 P05177 3/20 0.38
MEN1 O00255 2/20 0.38
HSP90AA1 P07900 2/20 0.38
BLM P54132 2/20 0.38
KMT2A Q03164 2/20 0.38
NR1H4 Q96RI1 2/20 0.38
TSHR P16473 2/20 0.38
TP53 P04637 1/20 0.38
CYP2C9 P11712 1/20 0.38
HIF1A Q16665 1/20 0.38
GLA P06280 1/20 0.38
PMP22 Q01453 1/20 0.38

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
SCHEMBL8653300 0.92 TDP1 (0.52) TDP1LMNACYP1A2MEN1KMT2A
Undecane SCHEMBL8665413 0.90 PAM (0.43) GPR84PAMLMNAMAPTPPARD
SCHEMBL6251850 0.87 MGAM (0.44) TDP1LMNACYP1A2MEN1KMT2A
SCHEMBL28679128 0.86 NAAA (0.50) TDP1GPR84MAPK1MAPTNPSR1
SCHEMBL15939743 0.86 NAAA (0.50) TDP1GPR84MAPK1MAPTNPSR1
SCHEMBL1722154 0.84 NAAA (0.55) TDP1GPR84MAPK1MAPTNPSR1
SCHEMBL11308819 0.84 NAAA (0.55) TDP1GPR84MAPK1MAPTNPSR1
SCHEMBL29180894 0.82 NAAA (0.52) TDP1GPR84MAPK1MAPTNPSR1
SCHEMBL8653303 0.81 MGAM (0.50) TDP1LMNACYP1A2MEN1KMT2A
SCHEMBL9794612 0.79 TDP1 (0.48) TDP1LMNAMEN1KMT2ATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5849821-A Tris-aryl-s-triazines substituted with biphenylyl groups CIBA SPECIALTY CHEMICALS CORPORATION (US) 1998-12-15 US claimed
US-5849821-A Tris-aryl-s-triazines substituted with biphenylyl groups CIBA SPECIALTY CHEMICALS CORPORATION (US) 1998-12-15 US disclosed
US-5844025-A 1,2-Bis-adducts of stable nitroxides with substituted ethylenes and stabilized compositions CIBA SPECIALTY CHEMICALS CORPORATION (US) 1998-12-01 US disclosed
US-5726309-A ULTRAVIOLET RADIATION ABSORBERS; THERMAL STABILIZERS FOR POLYMER SUBSTRATES, ESPECIALLY AUTOMOTIVE COATINGS CIBA SPECIALTY CHEMICALS CORPORATION (US) 1998-03-10 US disclosed
US-5684070-A FILM WITH TRIAZINE RESORCINOL COMPOUND STABILIZERS FOR RADIATION RESISTANCE CIBA SPECIALTY CHEMICALS CORPORATION (US) 1997-11-04 US disclosed
US-5681955-A PHOTOSTABILITY OF POLYMERS CIBA SPECIALTY CHEMICALS CORPORATION (US) 1997-10-28 US disclosed
US-5675004-A POLYMER STABILIZERS TO PROTECT AGAINST ACTINIC RADIATION COVERING MORE OF THE NEAR-UV SPECTRUM; DISCOLORATION INHIBITION; SYNERGISTIC EFFECT WITH HINDERED AMINES; ALKYD, ACRYLIC, URETHANE COATINGS CIBA-GEIGY CORPORATION (US) 1997-10-07 US disclosed
US-5512621-A STABILIZER FOR POLYOLEFINS CIBA-GEIGY CORPORATION (US) 1996-04-30 US disclosed