SCHEMBL6937808

SCHEMBL6937808

CC(Br)=C(c1ccc(N(C)C)cc1)c1ccc(N(C)C)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.52
HPGD P15428 3/20 0.52
MAPT P10636 3/20 0.52
ALOX15 P16050 4/20 0.50
TSHR P16473 3/20 0.50
MAPK1 P28482 3/20 0.50
HSD17B10 Q99714 2/20 0.50
CYP3A4 P08684 2/20 0.50
HBB P68871 1/20 0.50
RAB9A P51151 3/20 0.46
NPC1 O15118 3/20 0.46
KDM4E B2RXH2 1/20 0.46
KMT2A Q03164 4/20 0.45
MEN1 O00255 3/20 0.45
CA2 P00918 1/20 0.43
GFER P55789 1/20 0.42
SLC2A1 P11166 1/20 0.41
POLB P06746 2/20 0.41
GAA P10253 2/20 0.41
HDAC1 Q13547 1/20 0.41

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
SCHEMBL2326261 0.83 ALDH1A1 (0.65) ALDH1A1HPGDMAPTALOX15TSHR
SCHEMBL11421704 0.81 ALDH1A1 (0.56) ALDH1A1HPGDMAPTALOX15TSHR
SCHEMBL11024184 0.75 ALDH1A1 (0.61) ALDH1A1HPGDMAPTALOX15TSHR
SCHEMBL24851242 0.74 RAB9A (0.69) ALDH1A1HPGDMAPTALOX15TSHR
SCHEMBL2906433 0.71 MEN1 (0.59) ALDH1A1HPGDMAPTALOX15TSHR
SCHEMBL608828 0.71 MEN1 (0.59) ALDH1A1HPGDMAPTALOX15TSHR
SCHEMBL11044849 0.71 ALDH1A1 (0.56) ALDH1A1HPGDMAPTALOX15TSHR
SCHEMBL611461 0.71 ALDH1A1 (0.56) ALDH1A1HPGDMAPTALOX15TSHR
SCHEMBL23407821 0.71 TSHR (0.67) ALDH1A1HPGDMAPTALOX15TSHR
SCHEMBL10001067 0.71 RAB9A (0.77) ALDH1A1HPGDMAPTALOX15TSHR

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
EP-1167372-B1 2,2-(Diaryl)vinylphosphine compound, palladium catalyst thereof, and process for producing arylamine, diaryl, or arylalkyne with the catalyst TAKASAGO PERFUMERY CO LTD (JP) 2003-12-10 EP disclosed
US-6455720-B1 AS CATALYSTS TAKASAGO INTERNATIONAL CORPORATION (JP) 2002-09-24 US disclosed
US-20020058837-A1 2,2 (Diarlyl) Vinylphosphine compound, palladium catalyst thereof, and process for producing arylamine, diaryl, or arylalkyne with the catalyst TAKASAGO INTERNATIONAL CORPORATION (JP) 2002-05-16 US disclosed
EP-1167372-A1 2,2-(Diaryl)vinylphosphine compound, palladium catalyst thereof, and process for producing arylamine, diaryl, or arylalkyne with the catalyst Takasago International Corporation (JP) 2002-01-02 EP 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-20020058837-A1 2,2 (Diarlyl) Vinylphosphine compound, palladium catalyst thereof, and process for producing arylamine, diaryl, or arylalkyne with the catalyst DDT, PDCD11, PLD2 ALDH1A1 2369/4885HPGD 3594/4885MAPT 4856/4885

“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.