SCHEMBL8414433

SCHEMBL8414433

C1=C(OOC2=CCCCC2)CCCC1

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.34
HDAC4 P56524 1/20 0.33
HDAC2 Q92769 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33

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
SCHEMBL28422594 0.97 KDM1A (0.33) KDM1AHDAC4HDAC2HDAC8HDAC6
SCHEMBL1866814 0.91 HDAC3 (0.31) HDAC4HDAC2HDAC8HDAC6
SCHEMBL1134992 0.85 KDM1A (0.36) KDM1AHDAC4HDAC2HDAC8HDAC6
SCHEMBL10693409 0.85
SCHEMBL28584313 0.85
SCHEMBL28673559 0.84
SCHEMBL10876868 0.82 KDM1A (0.34) KDM1AHDAC4HDAC2HDAC8HDAC6
SCHEMBL10876875 0.82 KDM1A (0.34) KDM1AHDAC4HDAC2HDAC8HDAC6
SCHEMBL10876862 0.82 KDM1A (0.34) KDM1AHDAC4HDAC2HDAC8HDAC6
SCHEMBL1866810 0.80

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114082441-A MFI molecular sieve and preparation method and application thereof 江苏科技大学 2022-02-25 CN disclosed
US-5900513-A HYDROGENOLYSIS OF CYCLOHEXYL HYDROPEROXIDE USING INTERMETALLIC CATALYST CONTAINING PALLADIUM, LEAD, BISMUTH ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1999-05-04 US disclosed
US-4158647-A REDOX SYSTEM, QUICK-SETTING GAF CORPORATION (US) 1979-06-19 US disclosed
US-4104458-A Multifunctional acrylate N-vinylamide anaerobic adhesive composition GAF CORPORATION (US) 1978-08-01 US disclosed
US-3954683-A 1,2,2,2-Tetrachlorethyl acrylate and methacrylate polymers and copolymers CESKOSLOVENSKA AKADEMIE VED (CS) 1976-05-04 US disclosed