SCHEMBL4566672

SCHEMBL4566672

C=C(C)C.C=CCC=Cc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PAM P19021 1/20 0.47
HTR2A P28223 3/20 0.44
GLA P06280 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
CYP3A4 P08684 1/20 0.43
IDO1 P14902 2/20 0.42
ALOX15 P16050 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
SIGMAR1 Q99720 2/20 0.40
MAOB P27338 1/20 0.40
RELA Q04206 1/20 0.39
ALDH1A1 P00352 1/20 0.39
TSHR P16473 1/20 0.39

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
SCHEMBL30681 0.89 IDO1 (0.50) PAMHTR2ATDP1IDO1MEN1
SCHEMBL9903527 0.89 IDO1 (0.50) PAMHTR2ATDP1IDO1MEN1
Benzene SCHEMBL28645862 0.89 IDO1 (0.50) PAMHTR2ATDP1IDO1MEN1
SCHEMBL29695833 0.87 IDO1 (0.48) PAMHTR2ATDP1IDO1MEN1
Charcoal, Activated SCHEMBL9723294 0.87 IDO1 (0.48) PAMHTR2ATDP1IDO1MEN1
Butadiene SCHEMBL11880051 0.85 IDO1 (0.47) PAMHTR2ATDP1IDO1MEN1
SCHEMBL8055038 0.84 HTR2A (0.44) PAMHTR2AIDO1MEN1KMT2A
Phenol SCHEMBL27962172 0.84 PAM (0.47) PAMHTR2AGLATDP1CYP3A4
Styrene SCHEMBL8983406 0.83 ALDH1A1 (0.61) PAMHTR2ATDP1IDO1MEN1
Sulfuric Acid SCHEMBL4875630 0.82 PAM (0.50) PAMIDO1MAOBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230180747-A1 NONWOVEN FIBROUS WEBS AND METHODS OF MAKING AND USING THEREOF OHIO STATE INNOVATION FOUNDATION 2023-06-15 US claimed
WO-2021236794-A1 NONWOVEN FIBROUS WEBS AND METHODS OF MAKING AND USING THEREOF OHIO STATE INNOVATION FOUNDATION (US) 2021-11-25 WO claimed
US-7614349-B2 Less-lethal ammunition projectile THE UNIVERSITY OF WESTERN ONTARIO (CA) 2009-11-10 US claimed
US-20070234891-A1 Less-Lethal Ammunition Projectile WESTERN ONTARIO, UNIVERSITY OF, THE (CA) 2007-10-11 US claimed
WO-2005031246-A2 LESS-LETHAL AMMUNITION PROJECTILE THE UNIVERSITY OF WESTERN ONTARIO (CA) 2005-04-07 WO claimed
US-20230180747-A1 NONWOVEN FIBROUS WEBS AND METHODS OF MAKING AND USING THEREOF OHIO STATE INNOVATION FOUNDATION 2023-06-15 US disclosed
WO-2021236794-A1 NONWOVEN FIBROUS WEBS AND METHODS OF MAKING AND USING THEREOF OHIO STATE INNOVATION FOUNDATION (US) 2021-11-25 WO disclosed
US-7614349-B2 Less-lethal ammunition projectile THE UNIVERSITY OF WESTERN ONTARIO (CA) 2009-11-10 US disclosed
US-20070234891-A1 Less-Lethal Ammunition Projectile WESTERN ONTARIO, UNIVERSITY OF, THE (CA) 2007-10-11 US disclosed
WO-2005031246-A2 LESS-LETHAL AMMUNITION PROJECTILE THE UNIVERSITY OF WESTERN ONTARIO (CA) 2005-04-07 WO disclosed