SCHEMBL7788015

SCHEMBL7788015

CCCCC1(CCCC)CCc2ccccc21

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 10/20 0.51
ESR2 Q92731 2/20 0.50
EBP Q15125 1/20 0.46
KDM1A O60341 2/20 0.44
LMNA P02545 1/20 0.41
MAOB P27338 1/20 0.40
ESR1 P03372 1/20 0.39
ALOX12 P18054 1/20 0.38

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
SCHEMBL7782450 0.95 SIGMAR1 (0.51) SIGMAR1ESR2EBPKDM1ALMNA
SCHEMBL7782520 0.93 SIGMAR1 (0.54) SIGMAR1ESR2EBPKDM1ALMNA
SCHEMBL7788011 0.93 SIGMAR1 (0.54) SIGMAR1ESR2EBPKDM1ALMNA
SCHEMBL7788022 0.93 SIGMAR1 (0.54) SIGMAR1ESR2EBPKDM1ALMNA
SCHEMBL3296187 0.90 SIGMAR1 (0.54) SIGMAR1ESR2EBPKDM1A
SCHEMBL7782464 0.89 ESR2 (0.48) SIGMAR1ESR2EBPKDM1ALMNA
Ammonia Solution, Strong SCHEMBL27550700 0.87 ESR2 (0.47) SIGMAR1ESR2EBPKDM1ALMNA
SCHEMBL28549243 0.83 SIGMAR1 (0.56) SIGMAR1EBPKDM1A
SCHEMBL11198839 0.83 SIGMAR1 (0.56) SIGMAR1EBPKDM1A
SCHEMBL28548755 0.83 SIGMAR1 (0.56) SIGMAR1EBPKDM1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20010029286-A1 Procatalysts, catalyst systems, and use in OLEFIN polymerization EASTMAN CHEMICAL COMPANY, A CORP. OF DELAWARE 2001-10-11 US disclosed
US-20010025005-A1 Procatalysts, catalyst systems, and use in olefin polymerization EASTMAN CHEMICAL COMPANY, A CORPORATION OF DELAWARE 2001-09-27 US disclosed