SCHEMBL4900960

SCHEMBL4900960

Cc1cc(C2=NC(C)(C)CO2)ccc1Br

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.49
MAPT P10636 1/20 0.49
HTT P42858 1/20 0.49
KDM4E B2RXH2 1/20 0.45
IL2 P60568 1/20 0.43
HRH3 Q9Y5N1 4/20 0.42
CYP2D6 P10635 1/20 0.42
DAPK3 O43293 1/20 0.36
ABL1 P00519 1/20 0.35
HPGD P15428 1/20 0.35
S1PR1 P21453 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
SCHEMBL2727890 0.88 LMNA (0.49) LMNAMAPTHTTKDM4EIL2
SCHEMBL16264949 0.87 HTT (0.51) LMNAMAPTHTTKDM4EIL2
SCHEMBL14743593 0.84 HTT (0.49) LMNAMAPTHTTKDM4EIL2
SCHEMBL14743510 0.81 HTT (0.49) LMNAMAPTHTTKDM4EIL2
SCHEMBL4910720 0.81 HTT (0.46) LMNAMAPTHTTKDM4EIL2
SCHEMBL9997018 0.81 LMNA (0.46) LMNAMAPTHTTKDM4EIL2
SCHEMBL4910062 0.80 LMNA (0.48) LMNAMAPTHTTKDM4EIL2
SCHEMBL471858 0.79 KDM4E (0.60) LMNAMAPTHTTKDM4EIL2
SCHEMBL1763999 0.78 KDM4E (0.51) LMNAMAPTHTTKDM4EIL2
SCHEMBL25342747 0.78 LMNA (0.49) LMNAMAPTHTTKDM4EIL2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230287217-A1 Zwitterionic Cell-Permeant and Water-Soluble Rhodamine Dyes for Quantitative Imaging Applications OREGON HEALTH & SCIENCE UNIVERSITY 2023-09-14 US disclosed
US-20230287217-A1 Zwitterionic Cell-Permeant and Water-Soluble Rhodamine Dyes for Quantitative Imaging Applications OREGON HEALTH & SCIENCE UNIVERSITY 2023-09-14 US disclosed
US-20230287217-A1 Zwitterionic Cell-Permeant and Water-Soluble Rhodamine Dyes for Quantitative Imaging Applications OREGON HEALTH & SCIENCE UNIVERSITY 2023-09-14 US disclosed
EP-4225122-A1 ZWITTERIONIC CELL-PERMEANT AND WATER-SOLUBLE RHODAMINE DYES FOR QUANTITATIVE IMAGING APPLICATIONS Oregon Health & Science University (US) 2023-08-16 EP disclosed
US-9701841-B2 Cell permeable, fluorescent dye ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (EPFL) (CH) 2017-07-11 US disclosed
US-20160230011-A1 CELL PERMEABLE, FLUORESCENT DYE ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (EPFL) (CH) 2016-08-11 US disclosed
US-20080076760-A1 2,3,4,5-TETRAHYDRO-1H-1,5-BENZODIAZEPINE DERIVATIVE AND MEDICINAL COMPOSITION WAKAMOTO PHARMACEUTICAL CO., LTD (JP) 2008-03-27 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 (3 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-20080076760-A1 2,3,4,5-TETRAHYDRO-1H-1,5-BENZODIAZEPINE DERIVATIVE AND MEDICINAL COMPOSITION GABRA5, GABRA1, GABRB1 LMNA 2104/4885MAPT 3584/4885HTT 4213/4885
US-20160230011-A1 CELL PERMEABLE, FLUORESCENT DYE EPCAM, IK, TSPO LMNA 1312/4885MAPT 4366/4885HTT 3033/4885
US-20230287217-A1 Zwitterionic Cell-Permeant and Water-Soluble Rhodamine Dyes for Quantitative Imaging Applications SLC1A5, SLCO1B1, SLCO2B1 LMNA 498/4885MAPT 2459/4885HTT 2492/4885

“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.