SCHEMBL18015209

SCHEMBL18015209

CCOc1ccc(C2CC=C(C)CO2)c(C(F)(F)F)c1C(F)(F)F

nearest known ligand 0.32

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CTSS P25774 1/20 0.32
CTSK P43235 1/20 0.32
HTR2A P28223 3/20 0.31
HTR2C P28335 3/20 0.30
HTR2B P41595 3/20 0.30
KDM1A O60341 2/20 0.30
POLB P06746 1/20 0.30
GRK2 P25098 1/20 0.30
CASP6 P55212 1/20 0.30
CTDSP1 Q9GZU7 1/20 0.30

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
SCHEMBL18015211 0.82 KDM1A (0.33) HTR2AHTR2CHTR2BKDM1APOLB
SCHEMBL19466360 0.80 HTR2C (0.32) CTSSCTSKHTR2AHTR2CHTR2B
SCHEMBL18015220 0.78 FGFR2 (0.32) KDM1APOLBGRK2CASP6CTDSP1
SCHEMBL18006768 0.77 KDM4E (0.31)
SCHEMBL17070634 0.76 S1PR1 (0.32) HTR2AHTR2CHTR2BKDM1A
SCHEMBL18015228 0.74
SCHEMBL17348251 0.73 FPR2 (0.32) CTSSCTSKHTR2AHTR2CHTR2B
SCHEMBL18015207 0.73
SCHEMBL18015213 0.72 CPS1 (0.35)
SCHEMBL18015215 0.72 KDM1A (0.51) KDM1APOLBGRK2CASP6CTDSP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160230094-A1 LIQUID CRYSTAL COMPOUND HAVING A 3,6-DIHYDRO-2H-PYRAN RING, NEGATIVE DIELECTRIC ANISOTROPY, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2016-08-11 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-20160230094-A1 LIQUID CRYSTAL COMPOUND HAVING A 3,6-DIHYDRO-2H-PYRAN RING, NEGATIVE DIELECTRIC ANISOTROPY, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE DRD1, ZKSCAN2, ZRANB2 CTSS 4026/4885CTSK 3931/4885HTR2A 954/4885

“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.