SCHEMBL3419581

SCHEMBL3419581

COc1cccc2c1ccn2-c1ccc(I)cc1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 1/20 0.46
HTR2C P28335 1/20 0.44
HTR6 P50406 2/20 0.43
BCHE P06276 1/20 0.40
ACHE P22303 1/20 0.40
FABP4 P15090 2/20 0.38
APP P05067 1/20 0.37
MPO P05164 1/20 0.36
GPR119 Q8TDV5 1/20 0.36
RORC P51449 1/20 0.36
MAPT P10636 2/20 0.35
HTT P42858 1/20 0.35
DAO P14920 1/20 0.35
RHEB Q15382 1/20 0.35
GRM1 Q13255 1/20 0.34

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
SCHEMBL30234615 0.86 FFAR4 (0.52) FFAR4HTR2CHTR6RORCMAPT
SCHEMBL23883999 0.86 FFAR4 (0.52) FFAR4HTR2CHTR6RORCMAPT
SCHEMBL3418050 0.84 HTR6 (0.57) FFAR4HTR2CHTR6FABP4GPR119
SCHEMBL3420797 0.79 FFAR4 (0.44) FFAR4HTR2CHTR6ACHEMAPT
SCHEMBL28894113 0.78 HTR6 (0.47) FFAR4HTR2CHTR6BCHEACHE
SCHEMBL28337545 0.73 RPS6KA5 (0.53) FFAR4HTR2CHTR6FABP4MAPT
SCHEMBL29712008 0.71 HTR2C (0.47) FFAR4HTR2CHTR6FABP4RHEB
SCHEMBL29989576 0.71 RHEB (0.62) HTR2CHTR6FABP4MAPTRHEB
SCHEMBL347727 0.71 RHEB (0.62) HTR2CHTR6FABP4MAPTRHEB
SCHEMBL5216668 0.69 HTR2C (0.55) FFAR4HTR2CHTR6FABP4MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7767834-B2 Phosphonylated fluorescent dyes and conjugates ELITECH HOLDING B.V. (NL) 2010-08-03 US disclosed
US-7767834-B2 Phosphonylated fluorescent dyes and conjugates ELITECH HOLDING B.V. (NL) 2010-08-03 US disclosed
US-7767834-B2 Phosphonylated fluorescent dyes and conjugates ELITECH HOLDING B.V. (NL) 2010-08-03 US disclosed
EP-1991552-A2 PHOSPHONYLATED FLUORESCENT DYES AND CONJUGATES Epoch Biosciences, Inc. (US) 2008-11-19 EP disclosed
US-20080207887-A1 PHOSPHONYLATED FLUORESCENT DYES AND CONJUGATES EPOCH BIOSCIENCES, INC. (US) 2008-08-28 US disclosed
US-20080207887-A1 PHOSPHONYLATED FLUORESCENT DYES AND CONJUGATES EPOCH BIOSCIENCES, INC. (US) 2008-08-28 US disclosed
US-20080207887-A1 PHOSPHONYLATED FLUORESCENT DYES AND CONJUGATES EPOCH BIOSCIENCES, INC. (US) 2008-08-28 US disclosed
WO-2007098182-A2 PHOSPHONYLATED FLUORESCENT DYES AND CONJUGATES EPOCH BIOSCIENCES, INC. (US) 2007-08-30 WO disclosed
WO-2007098182-A2 PHOSPHONYLATED FLUORESCENT DYES AND CONJUGATES EPOCH BIOSCIENCES, INC. (US) 2007-08-30 WO disclosed
US-20060199955-A1 Phosphonylated fluorescent dyes and conjugates EPOCH BIOSCIENCES, INC. (US) 2006-09-07 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 (2 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-20080207887-A1 PHOSPHONYLATED FLUORESCENT DYES AND CONJUGATES PHOSPHO1, PFAS, PHPT1 FFAR4 4007/4885HTR2C 4424/4885HTR6 3402/4885
US-20060199955-A1 Phosphonylated fluorescent dyes and conjugates PHOSPHO1, PFAS, PHPT1 FFAR4 4007/4885HTR2C 4424/4885HTR6 3402/4885

“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.