SCHEMBL979565

SCHEMBL979565

O=C(C(F)=Cc1ccccc1)c1cc(F)c(F)c(F)c1F

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.39
NPC1 O15118 5/20 0.38
RAB9A P51151 5/20 0.38
KMT2A Q03164 4/20 0.38
CES2 O00748 4/20 0.38
CES1 P23141 4/20 0.38
AKR1C3 P42330 1/20 0.36
AKR1C1 Q04828 1/20 0.35
MEN1 O00255 1/20 0.35
MAPT P10636 1/20 0.33
NFKB1 P19838 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TUBB4A P04350 1/20 0.33
TUBB P07437 1/20 0.33
TUBA3C P0DPH7 1/20 0.33
TUBA1B P68363 1/20 0.33
TUBA4A P68366 1/20 0.33
TUBB4B P68371 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
SCHEMBL6352999 0.75 CES2 (0.52) RAB9ACES2CES1BCHE
SCHEMBL27914456 0.72 AKR1C1 (0.53) KMT2ACES2CES1AKR1C3AKR1C1
SCHEMBL27914457 0.72 AKR1C1 (0.53) KMT2ACES2CES1AKR1C3AKR1C1
SCHEMBL11179967 0.69 AKR1C3 (0.50) KMT2AAKR1C3AKR1C1MEN1MAPT
SCHEMBL211524 0.69 AKR1C3 (0.56) KMT2AAKR1C3AKR1C1MEN1MAPT
SCHEMBL2914673 0.69 AKR1C3 (0.56) KMT2AAKR1C3AKR1C1MEN1MAPT
SCHEMBL11179955 0.69 AKR1C3 (0.50) KMT2AAKR1C3AKR1C1MEN1MAPT
SCHEMBL3716652 0.69 AKR1C3 (0.56) KMT2AAKR1C3AKR1C1MEN1MAPT
SCHEMBL8769335 0.69 AKR1C3 (0.48) KMT2AAKR1C3MEN1MAPTPOLB
SCHEMBL4851418 0.69 CES2 (0.46) CES2CES1SMN1; SMN2BCHE

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-7872029-B2 Chalcone and its analogs as agents for the inhibition of angiogenesis and related disease states BOWEN J PHILLIP 2011-01-18 US disclosed
US-20090018167-A1 Chalcone and its analogs as agents for the inhibition of angiogenesis and related disease states Robinson, Thomas Philip (US) 2009-01-15 US disclosed
US-7432303-B2 Chalcone and its analogs as agents for the inhibition of angiogenesis and related disease states Bowen, J. Phillip (US) 2008-10-07 US disclosed
US-20050148599-A1 Chalcone and its analogs as agents for the inhibition of angiogenesis and related disease states UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. 2005-07-07 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-20090018167-A1 Chalcone and its analogs as agents for the inhibition of angiogenesis and related disease states FLT1, FLT4, VEGFA EGFR 30/4885NPC1 1709/4885RAB9A 2188/4885
US-20050148599-A1 Chalcone and its analogs as agents for the inhibition of angiogenesis and related disease states FLT1, VEGFA, FLT4 EGFR 21/4885NPC1 1134/4885RAB9A 2231/4885

“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.