SCHEMBL17070636

SCHEMBL17070636

CCOc1ccc(C2CCC(C)=CO2)cc1F

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 4/20 0.51
TUBB1 Q9H4B7 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.33
NAAA Q02083 1/20 0.32
SLC6A2 P23975 2/20 0.32
SLC6A4 P31645 2/20 0.32
SLC6A3 Q01959 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
HPGD P15428 1/20 0.32
TSHR P16473 1/20 0.32
HSD17B10 Q99714 1/20 0.32
MAPT P10636 1/20 0.32
HTT P42858 1/20 0.32
ACE2 Q9BYF1 1/20 0.31

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
SCHEMBL17068609 0.81 KDM1A (0.45) KDM1AL3MBTL1ACE2
SCHEMBL17070653 0.81 KDM1A (0.34) KDM1A
SCHEMBL17070628 0.81 IDO1 (0.35) KDM1ASLC6A2SLC6A4SLC6A3
SCHEMBL17070637 0.79 KDM1A (0.33) KDM1ASLC6A2SLC6A4SLC6A3MAPT
SCHEMBL17070652 0.75 S1PR1 (0.31) KDM1ASLC6A2SLC6A4SLC6A3ACE2
SCHEMBL18015215 0.74 KDM1A (0.51) KDM1ATUBB1L3MBTL1NAAA
SCHEMBL17070640 0.74 BRD4 (0.35)
SCHEMBL17070644 0.74 ACE2 (0.32) KDM1ASLC6A2SLC6A4SLC6A3ACE2
SCHEMBL19466368 0.74 KDM1A (0.53) KDM1ATUBB1L3MBTL1NAAAALDH1A1
SCHEMBL17070860 0.73

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-9523038-B2 Dihydropyran compound, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2016-12-20 US disclosed
US-20150252264-A1 DIHYDROPYRAN COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2015-09-10 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-20150252264-A1 DIHYDROPYRAN COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE DRD1, CNKSR1, DRG1 KDM1A 1110/4885TUBB1 4227/4885L3MBTL1 1727/4885

“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.