SCHEMBL989078

SCHEMBL989078

O=c1[nH]c(CO)nc2cc3c(cc12)CCC3

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 1/20 0.40
GRIN3B O60391 1/20 0.40
GRIN1 Q05586 1/20 0.40
GRIN2A Q12879 1/20 0.40
GRIN2B Q13224 1/20 0.40
GRIN2C Q14957 1/20 0.40
GRIN3A Q8TCU5 1/20 0.40
TDP1 Q9NUW8 3/20 0.39
ALDH1A1 P00352 2/20 0.39
TP53 P04637 1/20 0.39
ALOX15 P16050 1/20 0.39
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39
KDM4E B2RXH2 4/20 0.39
RECQL P46063 1/20 0.39
GAA P10253 1/20 0.37
MAPT P10636 1/20 0.37
HCAR2 Q8TDS4 1/20 0.36
PARP1 P09874 2/20 0.36
TNKS2 Q9H2K2 1/20 0.36

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
SCHEMBL988873 0.85 KDM4E (0.51) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL431949 0.81 MAPT (0.37) TDP1ALDH1A1KDM4ERECQLGAA
SCHEMBL6580601 0.80 ALDH1A1 (0.46) TDP1ALDH1A1TP53ALOX15TSHR
SCHEMBL10074706 0.77 PARP1 (0.37) TDP1ALDH1A1KDM4ERECQLGAA
SCHEMBL988602 0.77 ALDH1A1 (0.38) TDP1ALDH1A1TP53ALOX15TSHR
SCHEMBL29901709 0.76 KDM4E (0.57) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL6947094 0.76 KDM4E (0.57) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL8199108 0.76 ALDH1A1 (0.40) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL11089865 0.72 NPSR1 (0.32) ALDH1A1GAANPSR1
SCHEMBL30552887 0.69 TNKS2 (0.70) KDM4EMAPTPARP1TNKS2PARP2

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 42 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2595966-B1 SYNTHESIS OF CYCLOPENTAQUINAZOLINES BTG INT LTD (GB) 2020-10-28 EP disclosed
EP-2655398-B1 EFFICIENT PEPTIDE COUPLINGS AND THEIR USE IN THE SYNTHESIS AND ISOLATION OF A CYCLOPENTA (G) QUINAZOLINE TRISODIUM SALT BTG INT LTD (GB) 2016-08-24 EP disclosed
US-8809526-B2 Synthesis of cyclopentaquinazolines ONYX PHARMACEUTICALS, INC. (US) 2014-08-19 US disclosed
US-8809526-B2 Synthesis of cyclopentaquinazolines ONYX PHARMACEUTICALS, INC. (US) 2014-08-19 US disclosed
EP-2213664-B1 PROCESS FOR THE PREPARATION OF CYCLOPENTA[G]QUINAZOLINE DERIVATIVES BTG INT LTD (GB) 2014-04-30 EP disclosed
EP-2213664-B1 PROCESS FOR THE PREPARATION OF CYCLOPENTA[G]QUINAZOLINE DERIVATIVES BTG INT LTD (GB) 2014-04-30 EP disclosed
US-8552016-B2 Anti-cancer cyclopenta(g)quinazoline compounds BTG INTERNATIONAL LIMITED (GB) 2013-10-08 US disclosed
US-20130211082-A1 Synthesis of Cyclopentaquinazolines ONYX PHARMACEUTICALS, INC. (US) 2013-08-15 US disclosed
US-20130211082-A1 Synthesis of Cyclopentaquinazolines ONYX PHARMACEUTICALS, INC. (US) 2013-08-15 US disclosed
US-8486955-B2 Anti-cancer cyclopenta [g] quinazoline compounds BTG INTERNATIONAL LIMITED (GB) 2013-07-16 US disclosed
US-7250511-B2 Process for the preparation of cyclopenta[g]quinazoline derivatives BTG INTERNATIONAL LIMITED (GB) 2007-07-31 US disclosed
US-20050009851-A1 Use of cyclopeta[g]quinazoline derivatives for treating cancer BTG INTERNATIONAL LIMITED (GB) 2005-01-13 US disclosed
US-20040266798-A1 Process for the preparation of cyclopenta[g]quinazoline derivatives BTG INTERNATIONAL LIMITED (GB) 2004-12-30 US disclosed
US-20040242606-A1 Anti-cancer cyclopenta (g)quinazoline compounds BTG INTERNATIONAL LIMITED (GB) 2004-12-02 US disclosed
EP-1421105-A1 ANTI-CANCER CYCLOPENTA[G]QUINAZOLINE COMPOUNDS BTG INTERNATIONAL LIMITED (GB) 2004-05-26 EP disclosed
EP-1420809-A1 USE OF CYCLOPENTA[G]QUINAZOLINE DERIVATIVES FOR TREATING CANCER BTG International Limited (GB) 2004-05-26 EP disclosed
EP-1421069-A1 PROCESS FOR THE PREPARATION OF CYCLOPENTA[G]QUINAZOLINE DERIVATIVES BTG International Limited (GB) 2004-05-26 EP disclosed
WO-2003020748-A1 ANTI-CANCER CYCLOPENTA[G]QUINAZOLINE COMPOUNDS BTG INTERNATIONAL LIMITED (GB) 2003-03-13 WO disclosed
WO-2003020300-A1 USE OF CYCLOPENTA[G]QUINAZOLINE DERIVATIVES FOR TREATING CANCER BTG INTERNATIONAL LIMITED (GB) 2003-03-13 WO disclosed
WO-2003020706-A1 PROCESS FOR THE PREPARATION OF CYCLOPENTA[g]QUINAZOLINE DERIVATIVES BTG INTERNATIONAL LIMITED (GB) 2003-03-13 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 (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-20040266798-A1 Process for the preparation of cyclopenta[g]quinazoline derivatives COX6A1, MT-ND6, CYP2D6 GRIN2D 488/4885GRIN3B 354/4885GRIN1 999/4885
US-20130211082-A1 Synthesis of Cyclopentaquinazolines GLUL, QPCT, ASNS GRIN2D 6/4885GRIN3B 23/4885GRIN1 5/4885
US-20040242606-A1 Anti-cancer cyclopenta (g)quinazoline compounds H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, CBR1, NR4A1 GRIN2D 2178/4885GRIN3B 2271/4885GRIN1 1086/4885
US-20050009851-A1 Use of cyclopeta[g]quinazoline derivatives for treating cancer CNR1, NR3C1, NR0B1 GRIN2D 2014/4885GRIN3B 1289/4885GRIN1 380/4885

“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.