SCHEMBL236649

SCHEMBL236649

c1ccc2c(c1)CC1(CO2)COc2ccccc2C1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
OXTR P30559 1/20 0.42
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
ABCG2 Q9UNQ0 1/20 0.39
ITGB2 P05107 1/20 0.39
ICAM1 P05362 1/20 0.39
ITGAL P20701 1/20 0.39
KMT2A Q03164 1/20 0.35
LMNA P02545 2/20 0.34
CRHBP P24387 2/20 0.34
CRHR2 Q13324 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
HTT P42858 1/20 0.34
PKM P14618 1/20 0.34
TSHR P16473 1/20 0.34

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
SCHEMBL28644317 0.91 OXTR (0.39) OXTRMAOAMAOBABCG2ITGB2
SCHEMBL4229844 0.83 OXTR (0.42) OXTRKMT2ASMN1; SMN2TSHR
SCHEMBL23508721 0.82 TSHR (0.40) KMT2ATSHR
SCHEMBL7971051 0.78 OXTR (0.39) OXTRMAOAMAOBABCG2ITGB2
SCHEMBL17427498 0.78 ABCG2 (0.55) MAOAMAOBABCG2ITGB2ICAM1
SCHEMBL9033971 0.75 OXTR (0.37) OXTRMAOAMAOBABCG2ITGB2
SCHEMBL22560812 0.75 OXTR (0.37) OXTRMAOAMAOBABCG2ITGB2
SCHEMBL4214758 0.75 SIGMAR1 (0.62) KMT2ATSHR
SCHEMBL31012316 0.73 SIGMAR1 (0.34) MAOAMAOBKMT2ATSHR
SCHEMBL14182625 0.72 OXTR (0.39) OXTRMAOAMAOBABCG2

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
US-8974214-B2 Device for manufacturing optical film KONICA MINOLTA ADVANCED LAYERS, INC. (JP) 2015-03-10 US disclosed
US-8573792-B2 Reflective mirror for solar thermal power generation KONICA MINOLTA OPTO, INC. (JP) 2013-11-05 US disclosed
US-20130149405-A1 DEVICE FOR MANUFACTURING OPTICAL FILM KONICA MINOLTA ADVANCED LAYERS, INC. (JP) 2013-06-13 US disclosed
US-20120002311-A1 REFLECTIVE MIRROR FOR SOLAR THERMAL POWER GENERATION KONICA MINOLTA OPTO, INC. (JP) 2012-01-05 US disclosed
US-20090169772-A1 RETARDATION FILM, METHOD FOR PRODUCING RETARDATION FILM, POLARIZING PLATE AND LIQUID CRYSTAL DISPLAY KONICA MINOLTA OPTO, INC. (JP) 2009-07-02 US disclosed