SCHEMBL3821777

SCHEMBL3821777

OCC1OC1c1cccc(F)c1F

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 2/20 0.45
HTR2B P41595 2/20 0.45
SLC5A2 P31639 12/20 0.36
CES2 O00748 1/20 0.35
BCHE P06276 1/20 0.35
CES1 P23141 1/20 0.35
SLC5A1 P13866 2/20 0.32
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
MAPT P10636 1/20 0.31
CYP2C19 P33261 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
SCHEMBL3818874 0.84 SLC5A2 (0.43) HTR2CHTR2BSLC5A2CYP3A4CYP2D6
SCHEMBL4083854 0.84 SLC5A2 (0.43) HTR2CHTR2BSLC5A2CYP3A4CYP2D6
SCHEMBL3815130 0.76 HTR2A (0.44) HTR2CHTR2BSLC5A2SLC5A1
SCHEMBL18802133 0.73 MEN1 (0.37) HTR2CHTR2BSLC5A2CYP3A4CYP2D6
SCHEMBL30444497 0.73 MEN1 (0.37) HTR2CHTR2BSLC5A2CYP3A4CYP2D6
SCHEMBL16795878 0.73 MEN1 (0.37) HTR2CHTR2BSLC5A2CYP3A4CYP2D6
SCHEMBL30445125 0.73 MEN1 (0.37) HTR2CHTR2BSLC5A2CYP3A4CYP2D6
SCHEMBL15540266 0.73 MEN1 (0.37) HTR2CHTR2BSLC5A2CYP3A4CYP2D6
SCHEMBL5094784 0.72 SLC5A2 (0.50) SLC5A2SLC5A1
SCHEMBL15284629 0.72 SLC5A2 (0.48) SLC5A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2091933-A1 DIHYDROBENZOFURANYL DERIVATIVES AND METHODS OF THEIR USE Wyeth (US) 2009-08-26 EP disclosed
US-20080153873-A1 DIHYDROBENZOFURANYL DERIVATIVES AND METHODS OF THEIR USE WYETH (US) 2008-06-26 US disclosed
WO-2008073943-A1 DIHYDROBENZOFURANYL DERIVATIVES AND METHODS OF THEIR USE WYETH (US) 2008-06-19 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-20080153873-A1 DIHYDROBENZOFURANYL DERIVATIVES AND METHODS OF THEIR USE DBH, SLC6A3, SLC6A4 HTR2C 46/4885HTR2B 44/4885SLC5A2 15/4885

“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.