SCHEMBL7117489

SCHEMBL7117489

CCc1c(C#N)c(CC)c(CC)c(C#N)c1CC

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 6/20 0.45
▸ ALDH1A1 P00352 6/20 0.45
▸ KDM4E B2RXH2 6/20 0.45
▸ HSD17B10 Q99714 2/20 0.45
▸ ALOX15 P16050 1/20 0.45
▸ APOBEC3G Q9HC16 1/20 0.45
▸ KDM5A P29375 2/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ FPR1 P21462 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ CYP2A6 P11509 1/20 0.36
▸ MAPT P10636 5/20 0.35
▸ KMT2A Q03164 3/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ TDP1 Q9NUW8 2/20 0.35
▸ USP2 O75604 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ GAA P10253 2/20 0.33
▸ GLA P06280 1/20 0.32
▸ HTT P42858 1/20 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
SCHEMBL8149466 0.93 ALDH1A1 (0.45) HPGDALDH1A1KDM4EHSD17B10ALOX15
SCHEMBL12566682 0.87 ALDH1A1 (0.45) HPGDALDH1A1KDM4EHSD17B10ALOX15
SCHEMBL23529430 0.79 KDM4E (0.39) HPGDALDH1A1KDM4EHSD17B10ALOX15
SCHEMBL20334763 0.75 ALDH1A1 (0.36) HPGDALDH1A1KDM4EHSD17B10ALOX15
SCHEMBL11053903 0.73 HPGD (0.37) HPGDALDH1A1KDM4EHSD17B10ALOX15
SCHEMBL7034149 0.73 ALDH1A1 (0.37) HPGDALDH1A1KDM4EHSD17B10ALOX15
SCHEMBL19734298 0.73 KDM5A (0.45) HPGDALDH1A1KDM4EHSD17B10ALOX15
SCHEMBL24787159 0.72 KDM4E (0.34) HPGDALDH1A1KDM4EHSD17B10ALOX15
SCHEMBL19734742 0.72 MAPT (0.37) HPGDALDH1A1KDM4EHSD17B10ALOX15
SCHEMBL23652654 0.72 HPGD (0.36) HPGDALDH1A1KDM4EHSD17B10ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5720858-A Method for the photocatalytic conversion of methane THE UNITED STATES OF AMERICA AS REPRESENTED BY THE UNITED STATES DEPARTMENT OF ENERGY (US) 1998-02-24 — — US claimed
US-20030042126-A1 Process and reactor design for the photocatalytic conversion of natural gas to methanol CHEVRON U.S.A. INC. 2003-03-06 — — US disclosed
US-5720858-A Method for the photocatalytic conversion of methane THE UNITED STATES OF AMERICA AS REPRESENTED BY THE UNITED STATES DEPARTMENT OF ENERGY (US) 1998-02-24 — — US disclosed
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