SCHEMBL7311482

SCHEMBL7311482

O=C(O)C(=Cc1ccccc1Cl)C(=O)O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.50
TP53 P04637 1/20 0.47
MAPT P10636 3/20 0.46
NPC1 O15118 1/20 0.46
MAOB P27338 1/20 0.46
RAB9A P51151 1/20 0.46
HDAC1 Q13547 1/20 0.46
HDAC8 Q9BY41 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
GSR P00390 1/20 0.46
ALDH1A1 P00352 3/20 0.45
L3MBTL1 Q9Y468 1/20 0.44
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA4 P22748 1/20 0.43
CA7 P43166 1/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
LMNA P02545 1/20 0.43
HPGD P15428 1/20 0.43

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
SCHEMBL9477461 0.89 CA1 (0.52) TRPA1MAPTNPC1MAOBRAB9A
SCHEMBL9477455 0.89 CA1 (0.52) TRPA1MAPTNPC1MAOBRAB9A
SCHEMBL11021897 0.84 CA1 (0.43) TRPA1MAPTNPC1MAOBRAB9A
SCHEMBL16287426 0.84 TP53 (0.56) TP53CA1CA2CA4
SCHEMBL18306418 0.82 TP53 (0.39) TP53ALDH1A1MEN1KMT2A
SCHEMBL4049087 0.82 ALDH1A1 (0.42) TRPA1MAPTALDH1A1CA1CA2
SCHEMBL7281901 0.82 CES2 (0.44) TRPA1MAPTNPC1MAOBRAB9A
SCHEMBL4049090 0.82 ALDH1A1 (0.42) TRPA1MAPTALDH1A1CA1CA2
SCHEMBL6098480 0.82 TRPA1 (0.48) TRPA1MAPTNPC1MAOBRAB9A
SCHEMBL6098478 0.82 TRPA1 (0.48) TRPA1MAPTNPC1MAOBRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11236978-B2 Distance combat means for non-lethal exposure of the human or animal body to irritant BINDHAMMER MARKUS (DE) 2022-02-01 US claimed
EP-3510344-B1 LONG-RANGE WEAPON FOR NON-DEADLY CHARGE OF A HUMAN OR ANIMAL BODY WITH IRRITANT BINDHAMMER MARKUS (DE) 2020-04-15 EP claimed
US-20190212113-A1 DISTANCE COMBAT MEANS FOR NON-LETHAL EXPOSURE OF THE HUMAN OR ANIMAL BODY TO IRRITANT BINDHAMMER MARKUS (DE) 2019-07-11 US claimed
EP-3293479-B1 WEAPON FOR NON-DEADLY IMPACT WITH A HUMAN OR ANIMAL BODY WITH IRRITANT BINDHAMMER MARKUS (DE) 2019-01-09 EP claimed
EP-0499033-B1 Irritant agent cartridge or projectile with moulded on irritant agent charge in paste PIEPENBROCK PYROTECHNIK GMBH (DE) 1994-05-11 EP claimed
US-11236978-B2 Distance combat means for non-lethal exposure of the human or animal body to irritant BINDHAMMER MARKUS (DE) 2022-02-01 US disclosed
US-11236978-B2 Distance combat means for non-lethal exposure of the human or animal body to irritant BINDHAMMER MARKUS (DE) 2022-02-01 US disclosed
US-20190212113-A1 DISTANCE COMBAT MEANS FOR NON-LETHAL EXPOSURE OF THE HUMAN OR ANIMAL BODY TO IRRITANT BINDHAMMER MARKUS (DE) 2019-07-11 US disclosed
US-20190212113-A1 DISTANCE COMBAT MEANS FOR NON-LETHAL EXPOSURE OF THE HUMAN OR ANIMAL BODY TO IRRITANT BINDHAMMER MARKUS (DE) 2019-07-11 US disclosed
US-4824831-A CARDIOVASCULAR AGENTS E. R. SQUIBB & SONS, INC. (US) 1989-04-25 US disclosed
US-4329495-A USEFUL AS ANALGESICS OR ANTICONVULSANTS, CHIRAL 2-(2-BENZYL-3-MERCAPTOPROPIONYLAMINO)-THIOBUTYRIC ACIDS, OR ALKANOL DERIVATIVES PFIZER INC. (US) 1982-05-11 US disclosed