SCHEMBL979445

SCHEMBL979445

O=C(C=Cc1c2ccccc2cc2ccccc12)c1ccc2ccccc2c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1B1 Q16678 3/20 0.65
CYP1A2 P05177 3/20 0.58
CYP1A1 P04798 2/20 0.58
CYP2D6 P10635 2/20 0.57
CYP3A4 P08684 4/20 0.55
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
KDM4E B2RXH2 1/20 0.54
ALDH1A1 P00352 1/20 0.54
EGFR P00533 1/20 0.54
TP53 P04637 1/20 0.54
MAPT P10636 1/20 0.54
PKM P14618 1/20 0.54
HPGD P15428 1/20 0.54
ALOX15 P16050 1/20 0.54
ALOX12 P18054 1/20 0.54
JAK1 P23458 1/20 0.54
MAPK1 P28482 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
HSD17B10 Q99714 1/20 0.54

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
SCHEMBL973107 0.85 CYP3A4 (0.62) CYP1B1CYP1A2CYP1A1CYP2D6CYP3A4
SCHEMBL12948677 0.85 CYP3A4 (0.62) CYP1B1CYP1A2CYP1A1CYP2D6CYP3A4
SCHEMBL11815712 0.83 CYP1B1 (0.58) CYP1B1CYP1A2CYP1A1CYP2D6CYP3A4
SCHEMBL11815717 0.83 CYP1B1 (0.58) CYP1B1CYP1A2CYP1A1CYP2D6CYP3A4
Bromide SCHEMBL11817942 0.82 CYP1B1 (0.56) CYP1B1CYP1A2CYP1A1CYP2D6CYP3A4
Bromide SCHEMBL11817946 0.82 CYP1B1 (0.56) CYP1B1CYP1A2CYP1A1CYP2D6CYP3A4
SCHEMBL918337 0.80 CYP2D6 (0.63) CYP1B1CYP1A2CYP1A1CYP2D6CYP3A4
SCHEMBL918336 0.80 CYP2D6 (0.63) CYP1B1CYP1A2CYP1A1CYP2D6CYP3A4
SCHEMBL12948632 0.80 CYP1B1 (0.65) CYP1B1CYP1A2CYP1A1CYP2D6CYP3A4
SCHEMBL978654 0.80 CYP1B1 (0.65) CYP1B1CYP1A2CYP1A1CYP2D6CYP3A4

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 10 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
US-6906105-B2 Chalcone and its analogs as agents for the inhibition of angiogenesis and related disease states BOWEN J PHILLIP (US) 2005-06-14 US disclosed
US-20030027830-A1 Chalcone and its analogs as agents for the inhibition of angiogenesis and related disease states UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. 2003-02-06 US disclosed
US-6462075-B1 USE OF CHALCONE AND ITS DERIVATIVES AS ANTITUMOR/ANTICANCER AGENTS AND TO TREAT A NUMBER OF CONDITIONS OR DISEASE STATES IN WHICH ANGIOGENESIS IS A FACTOR INCLUDING PSORIASIS, ACNE, ROSACEA, WARTS, ECZEMA, HEMANGIOMAS AND LYMPHANGIOGENESIS THE UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. 2002-10-08 US disclosed
EP-1242352-A2 CHALCONE AND ITS ANALOGS AS AGENTS FOR THE INHIBITION OF ANGIOGENESIS AND RELATED DISEASE STATES UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. (US) 2002-09-25 EP disclosed
US-20020040029-A1 Chalcone and its analogs as agents for the inhibition of angiogenesis and related disease states BOWEN, J. PHILLIP 2002-04-04 US disclosed
WO-2001046110-A2 CHALCONE AND ITS ANALOGS AS AGENTS FOR THE INHIBITION OF ANGIOGENESIS AND RELATED DISEASE STATES THE UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. (US) 2001-06-28 WO 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 (4 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-20020040029-A1 Chalcone and its analogs as agents for the inhibition of angiogenesis and related disease states FLT1, FLT4, VEGFA CYP1B1 780/4885CYP1A2 795/4885CYP1A1 656/4885
US-20090018167-A1 Chalcone and its analogs as agents for the inhibition of angiogenesis and related disease states FLT1, FLT4, VEGFA CYP1B1 747/4885CYP1A2 792/4885CYP1A1 649/4885
US-20030027830-A1 Chalcone and its analogs as agents for the inhibition of angiogenesis and related disease states FLT1, VEGFA, FLT4 CYP1B1 604/4885CYP1A2 655/4885CYP1A1 625/4885
US-20050148599-A1 Chalcone and its analogs as agents for the inhibition of angiogenesis and related disease states FLT1, VEGFA, FLT4 CYP1B1 604/4885CYP1A2 655/4885CYP1A1 625/4885

“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.