SCHEMBL7102084

SCHEMBL7102084

Nc1ccccc1C1(O)CCCC1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 2/20 0.38
CYP3A4 P08684 1/20 0.38
CASP1 P29466 1/20 0.38
CASP7 P55210 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
ADORA3 P0DMS8 1/20 0.37
SIGMAR1 Q99720 1/20 0.37
PDK2 Q15119 1/20 0.37
HDAC4 P56524 1/20 0.37
OPRL1 P41146 3/20 0.37
OPRM1 P35372 2/20 0.37
OPRD1 P41143 2/20 0.37
OPRK1 P41145 2/20 0.37
AKR1C1 Q04828 1/20 0.36
TSHR P16473 1/20 0.36

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
SCHEMBL7101793 0.98 OPRM1 (0.37) ALOX15CYP3A4CASP1CASP7SMN1; SMN2
SCHEMBL632646 0.98 OPRM1 (0.37) ALOX15CYP3A4CASP1CASP7SMN1; SMN2
SCHEMBL29710660 0.96 ALOX15 (0.38) ALOX15CYP3A4CASP1CASP7SMN1; SMN2
SCHEMBL1703171 0.96 ALOX15 (0.38) ALOX15CYP3A4CASP1CASP7SMN1; SMN2
SCHEMBL2079404 0.91 ALOX15 (0.41) ALOX15CYP3A4CASP1CASP7SMN1; SMN2
SCHEMBL8222575 0.82 SIGMAR1 (0.57) ALOX15CYP3A4CASP1CASP7SMN1; SMN2
SCHEMBL92778 0.79 OPRM1 (0.45) SMN1; SMN2OPRL1OPRM1OPRD1OPRK1
SCHEMBL83658 0.79 OPRL1 (0.42) OPRL1OPRM1OPRD1OPRK1
SCHEMBL17733195 0.77 MEN1 (0.41) ALOX15CYP3A4SMN1; SMN2ADORA3SIGMAR1
SCHEMBL6058582 0.77 MEN1 (0.41) ALOX15CYP3A4SMN1; SMN2ADORA3SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1231456-C Process for preparing optically active cyclopropyl carboxylic acid derivative SUMITOMO CHEMICAL CO (JP) 2005-12-14 CN disclosed
CN-1480448-A Process for preparing optically active cyclopropyl carboxylic acid derivative ס�ѻ�ѧ��ҵ��ʽ���� 2004-03-10 CN disclosed
CN-1134422-C Optically active bisoxazoline compounds, process for their preparation and their use ������������ʽ���� 2004-01-14 CN disclosed
EP-0942010-B1 Transition metal compounds, catalyst components and catalysts for olefin polymerization, and process for producing olefinic polymer SUMITOMO CHEMICAL CO (JP) 2003-06-18 EP disclosed
US-6500909-B2 CONTAINING NICKEL, PALLADIUM, RHODIUM, RUTHENIUM, OR COBALT SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-12-31 US disclosed
US-6410741-B1 INSECTICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-06-25 US disclosed
US-20010027162-A1 Transition metal compound, catalyst component for olefin polymerization, catalyst for olefin polymerization, and process for producing olefinic polymer HIRAHATA WATARU (JP) 2001-10-04 US disclosed
US-6242377-B1 POLYMERIZATION IN PRESENCE OF BISOXAZOLINE WITH NICKEL, COBALT, PALLADIUM, RHODIUM, RUTHENIUM, ALUMINUM AND BORON COMPLEXES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-06-05 US disclosed
US-6072081-A Optically active bisoxazoline compounds, production and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-06-06 US disclosed
EP-0942010-A1 Transition metal compounds, catalyst components and catalysts for olefin polymerization, and process for producing olefinic polymers SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-09-15 EP disclosed
CN-1210858-A Optically active bisoxazoline compounds, process for their preparation and their use SUMITOMO CHEMICAL CO (JP) 1999-03-17 CN disclosed