SCHEMBL17430686

SCHEMBL17430686

CCOc1ccc(C2CCC(OCC)CC2)cc1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NQO1 P15559 1/20 0.50
TSHR P16473 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
MAOA P21397 2/20 0.42
MAOB P27338 2/20 0.42
DRD2 P14416 1/20 0.41
RAB9A P51151 1/20 0.40
MAPT P10636 1/20 0.40
LTA4H P09960 2/20 0.40
HRH3 Q9Y5N1 2/20 0.39
CACNA2D1 P54289 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
KCNH2 Q12809 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
SCHEMBL9586183 0.91 NQO1 (0.61) NQO1TSHRTDP1MAOAMAOB
SCHEMBL10017492 0.87 DRD2 (0.40) NQO1DRD2RAB9AHRH3CYP3A4
SCHEMBL10017493 0.86 DRD2 (0.55) MAOAMAOBDRD2MAPT
SCHEMBL12990842 0.84 ESR2 (0.53) NQO1TSHRTDP1MAOAMAOB
SCHEMBL10144013 0.83 NQO1 (0.56) NQO1TSHRTDP1MAOAMAOB
SCHEMBL8595900 0.82 NQO1 (0.50) NQO1TSHRTDP1MAOAMAOB
SCHEMBL10017496 0.82 NQO1 (0.50) NQO1TSHRTDP1MAOAMAOB
SCHEMBL8595904 0.82 SPHK1 (0.51) NQO1TSHRTDP1MAOAMAOB
SCHEMBL9349628 0.82 NQO1 (0.50) NQO1TSHRTDP1MAOAMAOB
SCHEMBL11838572 0.82 HRH3 (0.55) NQO1TSHRTDP1MAOAMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9470929-B2 Liquid crystal display unit and method of manufacturing the same SONY CORPORATION (JP) 2016-10-18 US disclosed
US-20160011463-A1 LIQUID CRYSTAL DISPLAY UNIT AND METHOD OF MANUFACTURING THE SAME SONY CORPORATION (JP) 2016-01-14 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20160011463-A1 LIQUID CRYSTAL DISPLAY UNIT AND METHOD OF MANUFACTURING THE SAME PYM1, PDCD2L, SDAD1 NQO1 4833/4885TSHR 4188/4885TDP1 801/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.