SCHEMBL21430438

SCHEMBL21430438

Cc1ccc(CCc2ccc(CCC3CCC(C)CC3)cc2)c(F)c1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.39
HTR2A P28223 7/20 0.36
HTR2C P28335 6/20 0.36
SLC6A2 P23975 1/20 0.34
SLC6A4 P31645 1/20 0.34
SLC6A3 Q01959 1/20 0.34
GPR84 Q9NQS5 1/20 0.33

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
SCHEMBL21019437 0.90 HTR2A (0.42) MAOBHTR2AHTR2C
SCHEMBL18503379 0.86 HTR2A (0.42) MAOBHTR2AHTR2C
SCHEMBL20827828 0.84 ESR2 (0.41) HTR2AHTR2C
SCHEMBL91857 0.83 MAOB (0.39) MAOBHTR2ASLC6A2SLC6A4SLC6A3
SCHEMBL8447276 0.82 MAOB (0.40) MAOBHTR2AHTR2CSLC6A2SLC6A4
SCHEMBL8447277 0.82 MAOB (0.40) MAOBHTR2AHTR2CSLC6A2SLC6A4
SCHEMBL22219356 0.82 HTR2A (0.33) MAOBHTR2AHTR2CSLC6A2SLC6A4
SCHEMBL16191373 0.81 MAOB (0.54) MAOBGPR84
SCHEMBL8448297 0.81 MAOB (0.40) MAOBHTR2AHTR2CSLC6A2SLC6A4
SCHEMBL8454671 0.81 MAOB (0.40) MAOBHTR2AHTR2CSLC6A2SLC6A4

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-10544365-B2 Nematic liquid crystal composition DIC CORPORATION (JP) 2020-01-28 US disclosed
WO-2019184860-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE 江苏和成显示科技有限公司 2019-10-03 WO 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-10544365-B2 Nematic liquid crystal composition DOCK5, CDKL5, NCS1 MAOB 4804/4885HTR2A 4252/4885HTR2C 3900/4885

“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.