SCHEMBL10367202

SCHEMBL10367202

CC(Oc1ccc(Oc2ccc(C#N)cc2)cc1)C(=O)Cl

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
PARP15 Q460N3 1/20 0.51
PARP10 Q53GL7 1/20 0.51
PARP2 Q9UGN5 1/20 0.51
MAPT P10636 2/20 0.50
KDM4E B2RXH2 1/20 0.50
MEN1 O00255 1/20 0.50
LMNA P02545 1/20 0.50
POLB P06746 1/20 0.50
PKM P14618 1/20 0.50
MAPK1 P28482 1/20 0.50
RAB9A P51151 1/20 0.50
KMT2A Q03164 1/20 0.50
IL18 Q14116 1/20 0.50
SCN9A Q15858 6/20 0.46
FPR2 P25090 1/20 0.46
SLC22A12 Q96S37 2/20 0.43
ALDH1A1 P00352 1/20 0.42
MMP2 P08253 2/20 0.42

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
SCHEMBL7841235 0.86 SLC22A12 (0.55) GAASMN1; SMN2PARP15PARP10PARP2
SCHEMBL7841233 0.86 SLC22A12 (0.55) GAASMN1; SMN2PARP15PARP10PARP2
Hydrochloric Acid SCHEMBL10367203 0.84 SLC22A12 (0.54) GAASMN1; SMN2PARP15PARP10PARP2
SCHEMBL10859732 0.84 FFAR1 (0.55) GAASMN1; SMN2MEN1KMT2ASCN9A
SCHEMBL28341259 0.83 GAA (0.52) GAASMN1; SMN2SCN9AFPR2
SCHEMBL10384832 0.83 GAA (0.52) GAASMN1; SMN2SCN9AFPR2
SCHEMBL9367506 0.80 GAA (0.49) GAASMN1; SMN2PARP15PARP10PARP2
SCHEMBL9362745 0.80 CYP1A2 (0.54) GAASMN1; SMN2PARP10PKMACACB
SCHEMBL21057155 0.80 GAA (0.59) GAASMN1; SMN2PARP15PARP10PARP2
SCHEMBL2830293 0.80 GAA (0.59) GAASMN1; SMN2PARP15PARP10PARP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4948420-A Herbicidal aryloxy phenoxy acyl malonates BUDAPESTI VEGYIMUVEK (HU) 1990-08-14 US disclosed
EP-0247424-B1 PROPIONIC ACID THIOL ESTER DERIVATIVES, PROCESSES FOR THEIR PRODUCTION AND HERBICIDAL COMPOSITIONS CONTAINING THEM Tosoh Corporation (JP) 1990-08-08 EP disclosed
US-4863938-A Pyridine derivatives and their use as nootropic agents CIBA-GEIGY CORPORATION (US) 1989-09-05 US disclosed
US-4841035-A HERBICIDES TOYO SODA MFG. CO. (JP) 1989-06-20 US disclosed
US-4765825-A PARTICULARLY EFFECTIVE AS PREEMERGENCE HERBICIDES FOR GRASSES BUDAPESTI VEGYIMUVEK (HU) 1988-08-23 US disclosed
US-4741756-A Propionic acid thiol ester derivatives and herbicidal compositions containing them TOYO SODA MFG. CO. (JP) 1988-05-03 US disclosed
EP-0247424-A1 Propionic acid thiol ester derivatives, processes for their production and herbicidal compositions containing them Tosoh Corporation (JP) 1987-12-02 EP disclosed
US-4608081-A SELECTIVITY AGAINST GRASSES KANESHO COMPANY LIMITED (JP) 1986-08-26 US disclosed
US-4600432-A CYANOPHENOXYPHENOXY COMPOUNDS AGRO-KANESHO CO., LTD. (JP) 1986-07-15 US disclosed