SCHEMBL7759307

SCHEMBL7759307

[c]1cc(Oc2ccccn2)ncn1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.40
LMNA P02545 3/20 0.35
CCR1 P32246 2/20 0.35
CCR5 P51681 2/20 0.35
CCR8 P51685 2/20 0.35
CYP1A2 P05177 2/20 0.35
POLB P06746 1/20 0.35
METAP1 P53582 1/20 0.35
BLM P54132 1/20 0.35
HIF1A Q16665 1/20 0.35
DOHH Q9BU89 1/20 0.35
P4HTM Q9NXG6 1/20 0.35
LTA4H P09960 1/20 0.34
PTGS2 P35354 1/20 0.34
PIN1 Q13526 1/20 0.33
TLR4 O00206 1/20 0.32
TLR2 O60603 1/20 0.32
TSHR P16473 1/20 0.32
NPC1 O15118 3/20 0.32
ALDH1A1 P00352 2/20 0.32

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
SCHEMBL409030 0.78 KDM4E (0.55) KDM4ELMNACCR1CCR5CCR8
SCHEMBL6773239 0.78 SMN1; SMN2 (0.47) CYP1A2LTA4HTSHRNPC1ALDH1A1
Hydrochloric Acid SCHEMBL28670387 0.76 KDM4E (0.53) KDM4ELMNACCR1CCR5CCR8
Phosphine SCHEMBL17979775 0.76 KDM4E (0.53) KDM4ELMNACCR1CCR5CCR8
SCHEMBL7754263 0.75 L3MBTL1 (0.37) PTGS2TSHRMAP4K4L3MBTL1
Ethylene SCHEMBL27741856 0.74 KDM4E (0.52) KDM4ELMNACCR1CCR5CCR8
SCHEMBL7758020 0.73 MAP4K4 (0.46) MAP4K4
SCHEMBL7759150 0.73 MAP4K4 (0.40) KDM4ECYP1A2LTA4HNPC1CYP2C19
SCHEMBL8062064 0.72 ALDH1A1 (0.47) LMNACYP1A2BLMTSHRALDH1A1
SCHEMBL8176365 0.72 SMN1; SMN2 (0.53) KDM4ELMNACYP1A2PTGS2TSHR

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