SCHEMBL7754263

SCHEMBL7754263

Clc1cccc(Oc2c[c]ncn2)n1

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.37
PTGS2 P35354 1/20 0.32
GRM4 Q14833 1/20 0.31
PPARG P37231 1/20 0.31
CYP3A4 P08684 1/20 0.31
TSHR P16473 1/20 0.31
EGFR P00533 1/20 0.31
ERBB3 P21860 1/20 0.31
MAP4K4 O95819 1/20 0.30

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
SCHEMBL7759307 0.75 KDM4E (0.40) L3MBTL1PTGS2TSHRMAP4K4
SCHEMBL8062064 0.72 ALDH1A1 (0.47) L3MBTL1TSHRMAP4K4
SCHEMBL7758132 0.71 HTT (0.42) L3MBTL1TSHR
SCHEMBL6773239 0.70 SMN1; SMN2 (0.47) L3MBTL1TSHRMAP4K4
SCHEMBL9491757 0.69 L3MBTL1 (0.53) L3MBTL1PTGS2PPARGCYP3A4TSHR
SCHEMBL2895213 0.69 L3MBTL1 (0.38) L3MBTL1PTGS2GRM4CYP3A4TSHR
SCHEMBL9492874 0.67 L3MBTL1 (0.51) L3MBTL1PTGS2PPARGCYP3A4TSHR
SCHEMBL2144034 0.66 L3MBTL1 (0.54) L3MBTL1PPARGTSHRMAP4K4
SCHEMBL9490952 0.66 L3MBTL1 (0.62) L3MBTL1PPARGCYP3A4TSHRMAP4K4
SCHEMBL2902897 0.66 L3MBTL1 (0.47) L3MBTL1PTGS2CYP3A4TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6211190-B1 Pyrimidine derivatives, process and intermediate products for their preparation and pesticides or fungicides containing these derivatives BASF AKTIENGESELLSCHAFT (DE) 2001-04-03 US disclosed
EP-0873305-B1 AZINOOXIMETHERS, PROCESSES AND INTERMEDIATE PRODUCTS FOR MANUFACTURING SAME, AND THE USES THEREOF IN COMBATING HARMFUL FUNGI AND PESTS BASF AG (DE) 2001-03-28 EP disclosed
EP-0873307-B1 CYANIMINO OXIME ETHERS, PROCESS AND INTERMEDIATES FOR THE PREPARATION AND USE THEREOF FOR THE CONTROL OF NOXIOUS FUNGI AND ANIMAL PESTS BASF AG (DE) 2000-05-31 EP disclosed
US-6063813-A FUNGICIDES AND INSECTICIDES BASF AKTIENGESELLSCHAFT (DE) 2000-05-16 US disclosed
US-6043282-A FUNGICIDES, PESTICIDES, INSECTICIDES, NEMATOCIDES, MITICIDES BASF AKTIENGESELLSCHAFT (DE) 2000-03-28 US disclosed
CN-1161687-A Phenylacetic acid alkyl esters BASF AG (DE) 1997-10-08 CN disclosed