SCHEMBL7633468

SCHEMBL7633468

Oc1ccc(Cn2nccn2)cc1Cl

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 6/20 0.50
DBH P09172 1/20 0.48
CA2 P00918 4/20 0.47
HSD17B10 Q99714 3/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
TSHR P16473 2/20 0.41
KMT2A Q03164 2/20 0.40
CA1 P00915 3/20 0.40
ESR2 Q92731 1/20 0.39
IGF1R P08069 1/20 0.39
ALOX15 P16050 1/20 0.39
GAA P10253 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HSD17B2 P37059 1/20 0.38
MAPK1 P28482 1/20 0.37

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
SCHEMBL7631427 0.79 ESR1 (0.55) CYP19A1DBHESR2HSD17B2
SCHEMBL7625992 0.77 GAA (0.55) CYP19A1DBHCA2HSD17B10TSHR
SCHEMBL7630007 0.77 CYP19A1 (0.61) CYP19A1DBHCA2CYP1A2CYP3A4
SCHEMBL11991675 0.75 CYP19A1 (0.42) CYP19A1DBHHSD17B10CYP3A4ESR2
SCHEMBL9773533 0.72 CA2 (0.61) CA2HSD17B10CYP1A2CYP3A4CYP2D6
SCHEMBL71042 0.72 HSD17B10 (0.63) DBHCA2HSD17B10CYP1A2CYP3A4
SCHEMBL10592557 0.71 DBH (0.51) DBHCA2HSD17B10CYP1A2CYP3A4
SCHEMBL4151517 0.70 SMN1; SMN2 (0.72) CYP2D6CYP2C19TSHRSMN1; SMN2
SCHEMBL1693883 0.70 CA2 (0.59) DBHCA2HSD17B10CYP1A2CYP3A4
SCHEMBL31256667 0.70 CA2 (0.59) DBHCA2HSD17B10CYP1A2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0754683-B1 ETHER COMPOUND, USE THEREOF, AND INTERMEDIATE FOR PRODUCING THE COMPOUND SUMITOMO CHEMICAL CO (JP) 2002-08-14 EP disclosed
CN-1079794-C Ether compound, use thereof, and intermediate for producing the compound SUMITOMO CHEM IND (JP) 2002-02-27 CN disclosed
US-5972949-A COMPOUNDS SUCH AS 4-(1-PYRAZOLYL)METHYLPHENYL 2-(2-PYRIMIDYLOXY) ETHYL ETHER; INSECTICIDAL AND/OR ACARICIDAL AGENTS SUMITO CHEMICAL CO., LTD. (JP) 1999-10-26 US disclosed
CN-1043041-C Heterocyclic group-containing ether derivative and insecticide containing the same as active ingredient SUMITOMO CHEMICAL CO (JP) 1999-04-21 CN disclosed
US-5883262-A INSECTICIDES, ACARICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-03-16 US disclosed
US-5684022-A ANTIFERTILITY AGENT PESTICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-11-04 US disclosed
CN-1151160-A Ether compound and use thereof SUMITOMO CHEMICAL CO (JP) 1997-06-04 CN disclosed
CN-1149289-A Ether compounds, their use and intermediates for their preparation SUMITOMO CHEMICAL CO (JP) 1997-05-07 CN disclosed
EP-0757048-A1 ETHER COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1997-02-05 EP disclosed
EP-0754683-A1 ETHER COMPOUND, USE THEREOF, AND INTERMEDIATE FOR PRODUCING THE COMPOUND SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1997-01-22 EP disclosed