SCHEMBL10367010

SCHEMBL10367010

CCOC(=O)c1cnn(-c2ccc(Cl)cc2Cl)c1C(F)(F)F

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.57
TRPC1 P48995 2/20 0.53
TRPC3 Q13507 2/20 0.53
STIM1 Q13586 2/20 0.53
ORAI1 Q96D31 2/20 0.53
STIM2 Q9P246 2/20 0.53
HTT P42858 1/20 0.51
KDM4E B2RXH2 7/20 0.51
HPGD P15428 6/20 0.51
ALDH1A1 P00352 5/20 0.51
L3MBTL1 Q9Y468 4/20 0.51
MEN1 O00255 3/20 0.51
KMT2A Q03164 3/20 0.51
GAA P10253 2/20 0.51
TDP1 Q9NUW8 1/20 0.51
CYP1A2 P05177 2/20 0.50
CYP2C9 P11712 2/20 0.50
CYP2C19 P33261 2/20 0.50
POLB P06746 1/20 0.48
MAPK1 P28482 1/20 0.47

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
SCHEMBL21604814 0.91 MAPT (0.57) MAPTTRPC1TRPC3STIM1ORAI1
SCHEMBL20265798 0.90 KDM4E (0.56) MAPTTRPC1TRPC3STIM1ORAI1
SCHEMBL30147880 0.90 KDM4E (0.56) MAPTTRPC1TRPC3STIM1ORAI1
SCHEMBL21605015 0.84 TRPC1 (0.53) MAPTTRPC1TRPC3STIM1ORAI1
SCHEMBL30147969 0.84 TRPC1 (0.53) MAPTTRPC1TRPC3STIM1ORAI1
SCHEMBL10678549 0.84 HTT (0.55) MAPTHTTKDM4EHPGDALDH1A1
SCHEMBL2325526 0.84 MAPT (0.76) MAPTTRPC1TRPC3STIM1ORAI1
SCHEMBL21604976 0.83 MAPT (0.56) MAPTTRPC1TRPC3STIM1ORAI1
SCHEMBL31117084 0.83 HTT (0.69) MAPTHTTHPGDALDH1A1MEN1
SCHEMBL2299638 0.82 SMN1; SMN2 (0.57) MAPTKDM4EALDH1A1MEN1KMT2A

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
EP-0151866-B1 HERBICIDAL PYRAZOLE-(THIO)-CARBOXAMIDES ELI LILLY AND COMPANY (US) 1990-07-25 EP disclosed
US-4620865-A Herbicidal and algicidal 1,5-disubstituted-1H-pyrazole-4-carboxamides ELI LILLY AND COMPANY (US) 1986-11-04 US disclosed
EP-0151866-A2 Herbicidal pyrazole-(thio)-carboxamides ELI LILLY AND COMPANY (US) 1985-08-21 EP disclosed