SCHEMBL11141237

SCHEMBL11141237

O=C(O)CO/N=C/c1c(Cl)cccc1Cl

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.56
KMT2A Q03164 5/20 0.50
CYP1A2 P05177 3/20 0.45
LMNA P02545 1/20 0.45
CYP2D6 P10635 1/20 0.45
TSHR P16473 1/20 0.45
BLM P54132 1/20 0.45
HIF1A Q16665 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
GPR55 Q9Y2T6 1/20 0.42
POLB P06746 1/20 0.42
CYP3A4 P08684 2/20 0.42
CYP2C19 P33261 2/20 0.42
AKR1B1 P15121 1/20 0.42
MEN1 O00255 4/20 0.41
ALDH1A1 P00352 4/20 0.41
SLC22A1 O15245 1/20 0.41
HTR1A P08908 1/20 0.41
ADRA2A P08913 1/20 0.41
CHRM1 P11229 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
SCHEMBL11141242 1.00 MAPT (0.56) MAPTKMT2ACYP1A2LMNACYP2D6
SCHEMBL11138300 0.90 RAB9A (0.49) MAPTKMT2ACYP1A2LMNACYP2C19
SCHEMBL11138302 0.90 RAB9A (0.49) MAPTKMT2ACYP1A2LMNACYP2C19
SCHEMBL11145517 0.90 MAPT (0.48) MAPTKMT2ACYP1A2LMNACYP2D6
SCHEMBL11142825 0.90 MAPT (0.48) MAPTKMT2ACYP1A2LMNACYP2D6
SCHEMBL11142820 0.90 MAPT (0.48) MAPTKMT2ACYP1A2LMNACYP2D6
SCHEMBL11145533 0.90 MAPT (0.48) MAPTKMT2ACYP1A2LMNACYP2D6
SCHEMBL11147729 0.87 MAPT (0.58) MAPTKMT2ACYP1A2LMNACYP2D6
SCHEMBL11147715 0.87 MAPT (0.58) MAPTKMT2ACYP1A2LMNACYP2D6
SCHEMBL11138653 0.87 MAPT (0.56) MAPTKMT2ACYP1A2LMNACYP2D6

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
US-4423241-A Herbicidal composition UNION CARBIDE CORPORATION (US) 1983-12-27 US claimed
US-4423241-A Herbicidal composition UNION CARBIDE CORPORATION (US) 1983-12-27 US disclosed
EP-0077854-A1 Herbicidal halogenated aromatic aminooxyacetic acid compounds and methods of use UNION CARBIDE CORPORATION (US) 1983-05-04 EP disclosed