SCHEMBL6937636

SCHEMBL6937636

CC(=C(c1ccc(F)cc1)c1ccc(F)cc1)P(c1ccccc1)c1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.36
NPC1 O15118 4/20 0.36
RAB9A P51151 3/20 0.36
ALDH1A1 P00352 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CES2 O00748 1/20 0.34
CES1 P23141 1/20 0.34
BCL2L1 Q07817 1/20 0.34
BAD Q92934 1/20 0.34
MEN1 O00255 4/20 0.34
KMT2A Q03164 4/20 0.34
MAPT P10636 1/20 0.34
CYP2C9 P11712 1/20 0.34
POLB P06746 2/20 0.33
KCNK3 O14649 1/20 0.33
KCNK9 Q9NPC2 1/20 0.33
LMNA P02545 1/20 0.33
PTBP1 P26599 1/20 0.33
HSD11B1 P28845 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
SCHEMBL6935690 0.86 ESR1 (0.42) ESR1CES2CES1POLBLMNA
SCHEMBL6938139 0.79 KMT2A (0.49) NPC1RAB9AALDH1A1SMN1; SMN2MEN1
SCHEMBL6935376 0.79 CES2 (0.49) ESR1NPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL4973930 0.75 TDP1 (0.45) ESR1SMN1; SMN2CES2CES1MAPT
SCHEMBL7113981 0.75 TDP1 (0.45) ESR1SMN1; SMN2CES2CES1MAPT
SCHEMBL25501695 0.74 ESR1 (0.47) ESR1NPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL7639635 0.69 NFE2L2 (0.44) NPC1RAB9AALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL7639633 0.69 NFE2L2 (0.44) NPC1RAB9AALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL9729472 0.69 NPC1 (0.47) NPC1RAB9AALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL17802360 0.68 NPC1 (0.46) NPC1RAB9AALDH1A1SMN1; SMN2L3MBTL1

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 ESR1 3506/4885NPC1 4752/4885RAB9A 219/4885

“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.