SCHEMBL4547010

SCHEMBL4547010

Fc1cc(F)cc(-c2cc(-c3ccccc3)cc(-c3cc(F)cc(F)c3)n2)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.53
KDM4E B2RXH2 3/20 0.47
MAPT P10636 2/20 0.47
MEN1 O00255 4/20 0.47
KMT2A Q03164 4/20 0.47
HPGD P15428 2/20 0.47
ALDH1A1 P00352 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
CTDSP1 Q9GZU7 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
RAB9A P51151 2/20 0.43
ADORA1 P30542 2/20 0.42
ADORA2A P29274 2/20 0.42
ADORA3 P0DMS8 1/20 0.41
ADORA2B P29275 1/20 0.41
TOP1 P11387 1/20 0.41
DHODH Q02127 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
RXFP1 Q9HBX9 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
SCHEMBL13203116 0.84 CYP19A1 (0.63) CYP19A1KDM4EMAPTMEN1KMT2A
SCHEMBL14425540 0.84 CYP19A1 (0.63) CYP19A1KDM4EMAPTMEN1KMT2A
SCHEMBL411336 0.84 ALDH1A1 (0.53) ALDH1A1CTDSP1TDP1
Biphenyl SCHEMBL28360045 0.84 ALDH1A1 (0.53) ALDH1A1CTDSP1TDP1
SCHEMBL28316619 0.84 KDM4E (0.43) CYP19A1KDM4EMAPTMEN1KMT2A
SCHEMBL28196237 0.83 MAPT (0.65) CYP19A1KDM4EMAPTMEN1KMT2A
SCHEMBL4355827 0.83 MAPT (0.65) CYP19A1KDM4EMAPTMEN1KMT2A
SCHEMBL31291015 0.83 MAPT (0.65) CYP19A1KDM4EMAPTMEN1KMT2A
SCHEMBL13916912 0.82 CYP19A1 (0.61) CYP19A1KDM4EMAPTMEN1KMT2A
SCHEMBL13203061 0.82 CYP19A1 (0.61) CYP19A1KDM4EMAPTMEN1KMT2A

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
US-8178215-B2 Organic compound containing at least two carbazolyl-substituted phenyl structures; charge-transporting material and organic el element containing the compound PIONEER CORPORATION (JP) 2012-05-15 US disclosed
US-8178215-B2 Organic compound containing at least two carbazolyl-substituted phenyl structures; charge-transporting material and organic el element containing the compound PIONEER CORPORATION (JP) 2012-05-15 US disclosed
US-20090236973-A1 ORGANIC COMPOUND, CHARGE-TRANSPORTING MATERIAL, AND ORGANIC ELECTROLUMINESCENT ELEMENT PIONEER CORPORATION (JO) 2009-09-24 US disclosed
US-20090236973-A1 ORGANIC COMPOUND, CHARGE-TRANSPORTING MATERIAL, AND ORGANIC ELECTROLUMINESCENT ELEMENT PIONEER CORPORATION (JO) 2009-09-24 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 (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-20090236973-A1 ORGANIC COMPOUND, CHARGE-TRANSPORTING MATERIAL, AND ORGANIC ELECTROLUMINESCENT ELEMENT SLCO4C1, SLCO2A1, SLCO2B1 CYP19A1 1485/4885KDM4E 2187/4885MAPT 2592/4885

“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.