SCHEMBL657749

SCHEMBL657749

O=C(C=Cc1ccc(-c2ccccc2)cc1)c1ccccc1

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.78
CYP1B1 Q16678 5/20 0.78
MAOB P27338 4/20 0.78
BCHE P06276 3/20 0.78
LMNA P02545 2/20 0.78
PLIN1 O60240 1/20 0.78
TNFRSF1A P19438 1/20 0.78
ACHE P22303 1/20 0.78
RECQL P46063 1/20 0.78
PLIN5 Q00G26 1/20 0.78
ABHD5 Q8WTS1 1/20 0.78
CYP3A4 P08684 4/20 0.73
KMT2A Q03164 3/20 0.73
NFKB1 P19838 2/20 0.73
NFKB2 Q00653 2/20 0.73
RELA Q04206 2/20 0.73
HSPD1 P10809 2/20 0.73
HSPE1 P61604 2/20 0.73
RAB9A P51151 2/20 0.73
PKM P14618 1/20 0.73

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
SCHEMBL657748 1.00 MAPT (0.78) MAPTCYP1B1MAOBBCHELMNA
SCHEMBL13680426 0.98 CYP1B1 (0.81) MAPTCYP1B1MAOBBCHELMNA
SCHEMBL12306205 0.96 CYP1B1 (0.71) MAPTCYP1B1MAOBBCHELMNA
SCHEMBL976912 0.96 CYP1B1 (0.71) MAPTCYP1B1MAOBBCHELMNA
Chalcone SCHEMBL28027252 0.94 CYP1B1 (0.88) MAPTCYP1B1MAOBBCHELMNA
SCHEMBL14045042 0.92 CYP1B1 (0.78) MAPTCYP1B1MAOBBCHELMNA
SCHEMBL979407 0.92 CYP1B1 (0.78) MAPTCYP1B1MAOBBCHELMNA
SCHEMBL9915665 0.92 CYP1B1 (0.91) MAPTCYP1B1MAOBBCHELMNA
SCHEMBL8431772 0.92 CYP1B1 (0.91) MAPTCYP1B1MAOBBCHELMNA
SCHEMBL12158776 0.91 CYP3A4 (0.90) MAPTCYP1B1MAOBBCHELMNA

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 20 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105367399-A Preparing method of 9,10-phenanthraquinone compound UNIV ZHEJIANG TECHNOLOGY 2016-03-02 CN claimed
EP-0926951-B1 TREATING PULMONARY DISEASES MEDIATED BY POLYUNSATURATED LIPID METABOLITES AND ASSAYS FOR EPOXIDE HYDROLASE INHIBITORS UNIV CALIFORNIA (US) 2004-04-21 EP claimed
CN-105367399-A Preparing method of 9,10-phenanthraquinone compound UNIV ZHEJIANG TECHNOLOGY 2016-03-02 CN disclosed
EP-2349999-B1 ALLOSTERIC PROTEIN KINASE MODULATORS UNIV SAARLAND (DE) 2016-01-27 EP disclosed
US-8912186-B2 Allosteric protein kinase modulators UNIVERSITAET DES SAARLANDES (DE) 2014-12-16 US disclosed
CN-103992356-A Michael addition product of ferrocene-based chalcone and ethyl acetoacetate and preparation method thereof UNIV SHAANXI SCIENCE & TECH 2014-08-20 CN disclosed
US-20120046307-A1 ALLOSTERIC PROTEIN KINASE MODULATORS UNIVERSITAET DES SAARLANDES (DE) 2012-02-23 US disclosed
EP-2349999-A1 ALLOSTERIC PROTEIN KINASE MODULATORS Universität des Saarlandes (DE) 2011-08-03 EP disclosed
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
WO-2010043711-A1 ALLOSTERIC PROTEIN KINASE MODULATORS UNIVERSITAET DES SAARLANDES (DE) 2010-04-22 WO disclosed
EP-2177510-A1 Allosteric protein kinase modulators Universität des Saarlandes (DE) 2010-04-21 EP 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 (5 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 MAPT 1111/4885CYP1B1 780/4885MAOB 2579/4885
US-20090018167-A1 Chalcone and its analogs as agents for the inhibition of angiogenesis and related disease states FLT1, FLT4, VEGFA MAPT 1274/4885CYP1B1 747/4885MAOB 2526/4885
US-20030027830-A1 Chalcone and its analogs as agents for the inhibition of angiogenesis and related disease states FLT1, VEGFA, FLT4 MAPT 341/4885CYP1B1 604/4885MAOB 1509/4885
US-20050148599-A1 Chalcone and its analogs as agents for the inhibition of angiogenesis and related disease states FLT1, VEGFA, FLT4 MAPT 341/4885CYP1B1 604/4885MAOB 1509/4885
US-20120046307-A1 ALLOSTERIC PROTEIN KINASE MODULATORS AURKC, AURKA, AURKB MAPT 964/4885CYP1B1 4714/4885MAOB 4512/4885

“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.