SCHEMBL17886151

SCHEMBL17886151

CCCn1ccc2cc(-c3cc(F)cc(F)c3)ccc21

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 1/20 0.52
HTR2A P28223 2/20 0.46
HTR2C P28335 2/20 0.46
GRM2 Q14416 5/20 0.41
CDK4 P11802 2/20 0.41
CCND1 P24385 2/20 0.41
HTR1D P28221 1/20 0.39
EGFR P00533 1/20 0.39
GLO1 Q04760 2/20 0.38
P2RX7 Q99572 1/20 0.38
GRIN2B Q13224 1/20 0.36
FAAH O00519 1/20 0.36

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
SCHEMBL18856959 0.85 HTR2C (0.59) SCN9AHTR2AHTR2CCDK4CCND1
SCHEMBL17886150 0.81 SCN9A (0.44) SCN9AHTR2AHTR2CGRM2HTR1D
SCHEMBL24418057 0.80 EGFR (0.50) SCN9AHTR2AHTR2CGRM2HTR1D
SCHEMBL14790349 0.80 SCN9A (0.47) SCN9AHTR2AHTR2CGRM2HTR1D
SCHEMBL18856954 0.76 HTR2C (0.56) SCN9AHTR2AHTR2CCDK4CCND1
SCHEMBL18856949 0.75 HTR2A (0.55) SCN9AHTR2AHTR2CCDK4CCND1
SCHEMBL9231907 0.74 HTR2A (0.54) SCN9AHTR2AHTR2CCDK4CCND1
SCHEMBL17676473 0.74 HTR2A (0.58) HTR2AHTR2CCDK4CCND1EGFR
SCHEMBL17867540 0.74 GRIN2B (0.35) SCN9AHTR2AHTR2CGRM2CDK4
SCHEMBL14061899 0.72 HTR2A (0.59) HTR2AHTR2CCDK4CCND1EGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9701904-B2 Optically isotropic liquid crystal medium and optical device JNC CORPORATION (JP) 2017-07-11 US disclosed
US-9701904-B2 Optically isotropic liquid crystal medium and optical device JNC CORPORATION (JP) 2017-07-11 US disclosed
US-20160186060-A1 OPTICALLY ISOTROPIC LIQUID CRYSTAL MEDIUM AND OPTICAL DEVICE JNC CORPORATION (JP) 2016-06-30 US disclosed
US-20160186060-A1 OPTICALLY ISOTROPIC LIQUID CRYSTAL MEDIUM AND OPTICAL DEVICE JNC CORPORATION (JP) 2016-06-30 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-20160186060-A1 OPTICALLY ISOTROPIC LIQUID CRYSTAL MEDIUM AND OPTICAL DEVICE CNOT1, SCO2, OCIAD1 SCN9A 3095/4885HTR2A 2423/4885HTR2C 1391/4885

“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.