SCHEMBL3123718

SCHEMBL3123718

CCCCc1nc(N(C)c2ccccc2)c2ccccc2n1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PDE5A O76074 2/20 0.55
▸ EGFR P00533 4/20 0.50
▸ PDE4A P27815 3/20 0.48
▸ PDE4B Q07343 3/20 0.48
▸ PDE4C Q08493 3/20 0.48
▸ PDE4D Q08499 3/20 0.48
▸ PDGFRB P09619 3/20 0.46
▸ KDR P35968 3/20 0.46
▸ ABCG2 Q9UNQ0 2/20 0.44
▸ PARP1 P09874 1/20 0.43

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
SCHEMBL2262157 0.81 PDE5A (0.59) PDE5AEGFRPDGFRBKDRABCG2
SCHEMBL12409984 0.77 SMN1; SMN2 (0.53) PDE5A
SCHEMBL14842813 0.75 ALDH1A1 (0.49) PDE4APDE4BPDE4CPDE4DPARP1
SCHEMBL7835433 0.74 PDE4A (0.49) PDE4APDE4BPDE4CPDE4DPARP1
SCHEMBL3110573 0.74 EGFR (0.70) PDE5AEGFRPDGFRBKDR
SCHEMBL3960222 0.74 EGFR (0.58) EGFRPDGFRBKDR
SCHEMBL3106198 0.74 EGFR (0.65) EGFRPDGFRBKDR
SCHEMBL3117685 0.73 PDE5A (0.66) PDE5AEGFRPDGFRBKDRABCG2
SCHEMBL3964198 0.73 EGFR (0.56) EGFRPDGFRBKDR
SCHEMBL3954930 0.73 EGFR (0.57) EGFRPDGFRBKDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170050937-A1 COMPOUNDS AND THERAPEUTICAL USE THEREOF MYRIAD GENETICS, INC. 2017-02-23 — — US disclosed
US-20130029942-A1 COMPOUNDS AND THERAPEUTICAL USES THEREOF MYREXIS, INC. (US) 2013-01-31 — — US disclosed
US-8309562-B2 Compounds and therapeutical use thereof MYREXIS, INC. (US) 2012-11-13 — — US disclosed
CN-1984660-B 4-arylamino-quinazolines as activators of aspartic acid specificity cysteine protease and inducers of apoptosis MYRIAD GENETICS INC 2010-12-15 — — CN disclosed
US-20100069383-A1 COMPOUNDS AND THERAPEUTICAL USE THEREOF Myriad Pharmaceuticals, Incorporated (US) 2010-03-18 — — US disclosed
US-7618975-B2 4-arylamino-quinazolines and analogs as activators of caspases and inducers of apoptosis and the use thereof MYRIAD PHARMACEUTICALS, INC. (US) 2009-11-17 — — US disclosed
US-20080039479-A1 COMPOUNDS AND THERAPEUTICAL USE THEREOF MYRIAD GENETICS, INCORPORATED (US) 2008-02-14 — — US disclosed
US-20080032974-A1 COMPOUNDS AND THERAPEUTICAL USE THEREOF MYRIAD GENETICS, INCORPORATED (US) 2008-02-07 — — US disclosed
US-20070249601-A1 COMPOUNDS AND THERAPEUTICAL USE THEREOF MYRIAD GENETICS, INCORPORATED (US) 2007-10-25 — — US disclosed
US-20070244114-A1 COMPOUNDS AND THERAPEUTICAL USE THEREOF MYRIAD GENETICS, INCORPORATED (US) 2007-10-18 — — US disclosed
US-20070244113-A1 COMPOUNDS AND THERAPEUTICAL USE THEREOF MYRIAD GENETICS, INCORPORATED (US) 2007-10-18 — — US disclosed
US-20070208044-A1 COMPOUNDS AND THERAPEUTICAL USE THEREOF MYRIAD GENETICS, INCORPORATED (US) 2007-09-06 — — US disclosed
CN-1984660-A 4-arylamino-quinazolines as activators of aspartic acid specificity cysteine protease and inducers of apoptosis MYRIAD GENETICS INC (US) 2007-06-20 — — CN disclosed
EP-1660092-A2 4-ARYLAMINO-QUINAZOLINES AS ACTIVATORS OF CASPASES AND INDUCERS OF APOPTOSIS Myriad Genetics, Inc. (US) 2006-05-31 — — EP disclosed
US-20050137213-A1 Compounds and therapeutical use thereof MYRIAD GENETICS, INCORPORATED (US) 2005-06-23 — — US disclosed
WO-2005003100-A2 4-ARYLAMINO-QUINAZOLINES AS ACTIVATORS OF CASPASES AND INDUCERS OF APOPTOSIS MYRIAD GENETICS, INC. (US) 2005-01-13 — — 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 (10 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-20070208044-A1 COMPOUNDS AND THERAPEUTICAL USE THEREOF BAD, CASP3, BAX PDE5A 2855/4885EGFR 2915/4885PDE4A 1377/4885
US-20130029942-A1 COMPOUNDS AND THERAPEUTICAL USES THEREOF BAD, CASP3, BAX PDE5A 2924/4885EGFR 3147/4885PDE4A 1408/4885
US-20100069383-A1 COMPOUNDS AND THERAPEUTICAL USE THEREOF BAD, CASP3, BAX PDE5A 3000/4885EGFR 2648/4885PDE4A 1512/4885
US-20070244113-A1 COMPOUNDS AND THERAPEUTICAL USE THEREOF BAD, CASP3, BAX PDE5A 2855/4885EGFR 2915/4885PDE4A 1377/4885
US-20080032974-A1 COMPOUNDS AND THERAPEUTICAL USE THEREOF BAD, CASP3, BAX PDE5A 2855/4885EGFR 2915/4885PDE4A 1377/4885
US-20170050937-A1 COMPOUNDS AND THERAPEUTICAL USE THEREOF BAD, CASP3, BAX PDE5A 2855/4885EGFR 2915/4885PDE4A 1377/4885
US-20050137213-A1 Compounds and therapeutical use thereof BAD, CASP3, BAX PDE5A 2855/4885EGFR 2915/4885PDE4A 1377/4885
US-20070244114-A1 COMPOUNDS AND THERAPEUTICAL USE THEREOF BAD, CASP3, BAX PDE5A 2855/4885EGFR 2915/4885PDE4A 1377/4885
US-20080039479-A1 COMPOUNDS AND THERAPEUTICAL USE THEREOF BAD, CASP3, BAX PDE5A 2855/4885EGFR 2915/4885PDE4A 1377/4885
US-20070249601-A1 COMPOUNDS AND THERAPEUTICAL USE THEREOF BAD, CASP3, BAX PDE5A 2855/4885EGFR 2915/4885PDE4A 1377/4885

“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.

Send feedback