SCHEMBL9717338

SCHEMBL9717338

C(CCCC1CCCCC1)CCC1CCCCC1

nearest known ligand 0.75

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 4/20 0.75
CYP1A2 P05177 1/20 0.65
KDM5A P29375 3/20 0.46
PHF8 Q9UPP1 3/20 0.46
KDM2A Q9Y2K7 3/20 0.46
KDM4C Q9H3R0 2/20 0.46
KDM4A O75164 1/20 0.46
EPHX1 P07099 1/20 0.44
NAAA Q02083 2/20 0.42
GPR84 Q9NQS5 1/20 0.42

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
SCHEMBL9188143 1.00 SIGMAR1 (0.75) SIGMAR1CYP1A2KDM5APHF8KDM2A
SCHEMBL8861204 1.00 SIGMAR1 (0.75) SIGMAR1CYP1A2KDM5APHF8KDM2A
SCHEMBL11310798 1.00 SIGMAR1 (0.75) SIGMAR1CYP1A2KDM5APHF8KDM2A
SCHEMBL11440477 1.00 SIGMAR1 (0.75) SIGMAR1CYP1A2KDM5APHF8KDM2A
SCHEMBL728711 1.00 SIGMAR1 (0.75) SIGMAR1CYP1A2KDM5APHF8KDM2A
SCHEMBL4466278 1.00 SIGMAR1 (0.75) SIGMAR1CYP1A2KDM5APHF8KDM2A
SCHEMBL7915243 1.00 SIGMAR1 (0.75) SIGMAR1CYP1A2KDM5APHF8KDM2A
SCHEMBL2593251 1.00 SIGMAR1 (0.75) SIGMAR1CYP1A2KDM5APHF8KDM2A
SCHEMBL9194529 1.00 SIGMAR1 (0.75) SIGMAR1CYP1A2KDM5APHF8KDM2A
SCHEMBL11481678 0.97 SIGMAR1 (0.71) SIGMAR1CYP1A2KDM5APHF8KDM2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113122059-A Preparation method of ink and quantum dot film TCL集团股份有限公司 2021-07-16 CN claimed
CN-113122059-A Preparation method of ink and quantum dot film TCL集团股份有限公司 2021-07-16 CN disclosed
CN-101945936-B Ionomeric polyester copolymer/organoclay nanocomposites, method of manufacture, and articles formed therefrom SABIC INNOVATIVE PLASTICS IP 2014-01-22 CN disclosed
EP-0308896-B1 METHOD FOR PRODUCING A CYCLOALKANOL MITSUBISHI KASEI CORPORATION (JP) 1992-03-18 EP disclosed
US-4933508-A OXIDIZING CYCLOALKANE WITH OXYGEN IN LIQUID PHASE USING BORON OR COBALT-CONTAINING CATALYST; AROMATIC NITRO COMPOUND TO INCREASE SELECTIVITY MITSUBISHI KASEI CORPORATION (JP) 1990-06-12 US disclosed
EP-0308896-A1 Method for producing a cycloalkanol MITSUBISHI KASEI CORPORATION (JP) 1989-03-29 EP disclosed