SCHEMBL7759150

SCHEMBL7759150

[c]1cc(Oc2ccncc2)ncn1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAP4K4 O95819 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.33
LTA4H P09960 1/20 0.32
NPC1 O15118 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
RAB9A P51151 1/20 0.32
SCN9A Q15858 1/20 0.30
KDM4E B2RXH2 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
SCHEMBL6773239 0.83 SMN1; SMN2 (0.47) MAP4K4SMN1; SMN2LTA4HNPC1CYP1A2
SCHEMBL17764755 0.80 MEN1 (0.45) KDM4E
SCHEMBL5194735 0.80 MEN1 (0.50) MAP4K4SMN1; SMN2NPC1CYP2C9RAB9A
SCHEMBL7758132 0.80 HTT (0.42) SMN1; SMN2LTA4HNPC1CYP1A2CYP2C9
SCHEMBL7759131 0.80 LMNA (0.47) MAP4K4SMN1; SMN2LTA4H
SCHEMBL7759307 0.73 KDM4E (0.40) MAP4K4SMN1; SMN2LTA4HNPC1CYP1A2
SCHEMBL8540552 0.67 LMNA (0.47) MAP4K4SMN1; SMN2LTA4HSCN9A
SCHEMBL5924062 0.67 LMNA (0.40) NPC1CYP1A2CYP2C9CYP2C19RAB9A
SCHEMBL8176365 0.67 SMN1; SMN2 (0.53) MAP4K4SMN1; SMN2NPC1CYP1A2CYP2C9
SCHEMBL8062064 0.67 ALDH1A1 (0.47) MAP4K4CYP1A2CYP2C19SCN9A

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 7 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
US-6200997-B1 CYCLIZATION TO GIVE OXAZOLIDINEDIONES AND TRIAZOLIDINEDIONES BASF AKTIENGESELLSCHAFT (DE) 2001-03-13 US 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