SCHEMBL2933979

SCHEMBL2933979

O=C1CCC(Cc2ccccc2)CO1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 1/20 0.44
MAOB P27338 1/20 0.43
HTR1A P08908 4/20 0.42
SIGMAR1 Q99720 4/20 0.42
DDB1 Q16531 1/20 0.41
CRBN Q96SW2 1/20 0.41
CYP19A1 P11511 1/20 0.41
CCR3 P51677 1/20 0.41
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
GRIN2B Q13224 1/20 0.40
TAAR1 Q96RJ0 1/20 0.39

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
SCHEMBL28496876 0.89 CA1 (0.43) GBA1MAOBHTR1ASIGMAR1DDB1
SCHEMBL7977009 0.82 CHRM5 (0.47) GBA1MAOBHTR1ASIGMAR1CYP19A1
SCHEMBL5236823 0.82 CHRM5 (0.47) GBA1MAOBHTR1ASIGMAR1CYP19A1
SCHEMBL5859935 0.82 CHRM5 (0.47) GBA1MAOBHTR1ASIGMAR1CYP19A1
SCHEMBL9236758 0.82 MAOB (0.40) MAOBCYP19A1TAAR1
SCHEMBL5675291 0.76 GBA1 (0.57) GBA1HTR1ASIGMAR1DDB1CRBN
SCHEMBL8772735 0.74 GBA1 (0.46) GBA1MAOBHTR1ASIGMAR1CCR3
SCHEMBL4865573 0.73 GBA1 (0.48) GBA1HTR1ASIGMAR1DDB1CRBN
SCHEMBL4865561 0.73 GBA1 (0.48) GBA1HTR1ASIGMAR1DDB1CRBN
SCHEMBL12040400 0.72 CRBN (0.53) GBA1DDB1CRBNCYP19A1CCR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112107690-B Preparation method of camptothecine drug nanoparticles 浙江工业大学 2023-05-30 CN claimed
CN-112107690-B Preparation method of camptothecine drug nanoparticles 浙江工业大学 2023-05-30 CN disclosed
EP-3150578-B1 NOVEL PYRROLIDINE COMPOUND AND APPLICATION AS MELANOCORTIN RECEPTOR AGONIST MITSUBISHI TANABE PHARMA CORP (JP) 2020-10-14 EP disclosed
US-8440608-B2 Beta-substituted tetrandropyrana (on) s and method for the synthesis and the use thereof V. MANE FILS (FR) 2013-05-14 US disclosed
EP-1773284-B1 BETA-SUBSTITUTED TETRAHYDROPYRAN(ON)S AND METHOD FOR THE SYNTHESIS AND THEIR USE IN PERFUMERY MANE FILS V (FR) 2010-09-15 EP disclosed
CN-100508941-C Beta-substituted tetrahydropyrans (ketones), method for the synthesis thereof and use thereof MANE FILS V (FR) 2009-07-08 CN disclosed
US-20080032914-A1 Beta-Substituted Tetrahdropyrana (On) S And Method For The Synthesis And The Use Thereof V. MANE FILS (FR) 2008-02-07 US disclosed
CN-101001605-A Beta-substituted tetrahydropyran(on)s and method for the synthesis and the use thereof MANE FILS V (FR) 2007-07-18 CN disclosed
EP-1773284-A1 BETA-SUBSTITUTED TETRAHYDROPYRAN(ON)S AND METHOD FOR THE SYNTHESIS AND THE USE THEREOF V. Mane Fils (FR) 2007-04-18 EP disclosed
WO-2006021663-A1 BETA-SUBSTITUTED TETRAHYDROPYRAN(ON)S AND METHOD FOR THE SYNTHESIS AND THE USE THEREOF V. MANE FILS (FR) 2006-03-02 WO disclosed