SCHEMBL402059

SCHEMBL402059

COc1cccc(Cc2nc3ccc(C(=O)O)cc3c(=O)[nH]2)c1

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 1/20 0.61
MMP13 P45452 7/20 0.51
KDM4E B2RXH2 2/20 0.48
LMNA P02545 1/20 0.48
HSD17B10 Q99714 1/20 0.48
ROCK2 O75116 1/20 0.48
HCAR3 P49019 1/20 0.47
RECQL P46063 1/20 0.47
KMT2A Q03164 1/20 0.47
KDM4C Q9H3R0 1/20 0.47
KDM5B Q9UGL1 1/20 0.47
GRIN1 Q05586 1/20 0.47
GRIN2B Q13224 1/20 0.47

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
SCHEMBL401645 0.93 PDE5A (0.72) PDE5AMMP13KDM4EHCAR3RECQL
SCHEMBL405533 0.85 PDE5A (0.65) PDE5AKDM4ERECQLKMT2A
SCHEMBL943018 0.84 GRIN1 (0.51) MMP13KDM4ELMNAHSD17B10ROCK2
SCHEMBL403588 0.83 PDE5A (0.53) PDE5AKDM4ELMNARECQL
SCHEMBL401291 0.83 PDE5A (0.85) PDE5AKDM4ERECQLKMT2AKDM4C
SCHEMBL399659 0.83 PDE5A (0.59) PDE5AMMP13KDM4EHSD17B10RECQL
SCHEMBL406149 0.83 PDE5A (0.59) PDE5AMMP13KDM4EHCAR3RECQL
SCHEMBL403714 0.82 PDE5A (0.69) PDE5AMMP13KDM4ERECQLKMT2A
SCHEMBL404509 0.81 PDE5A (0.57) PDE5AMMP13KDM4EHCAR3RECQL
SCHEMBL400954 0.81 PDE5A (0.68) PDE5AMMP13KDM4ERECQLKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2050739-B1 QUINAZOLINE DERIVATIVE ASKA PHARM CO LTD (JP) 2016-07-06 EP disclosed
CN-101501007-B Quinazoline derivative ASKA PARMACEUTICAL CO LTD 2014-01-29 CN disclosed
US-8101624-B2 Quinazoline derivatives ASKA PHARMACEUTICAL CO., LTD. (JP) 2012-01-24 US disclosed
US-20100113484-A1 TREATING AGENT OF UROPATHY ASKA PHARMACEUTICAL CO., LTD. (JP) 2010-05-06 US disclosed
US-20090318478-A1 QUINAZOLINE DERIVATIVES ASKA PHARMACEUTICAL CO., LTD. 2009-12-24 US disclosed
EP-2123301-A1 THERAPEUTIC AGENT FOR URINARY TRACT DISEASE ASKA Pharmaceutical Co., Ltd. (JP) 2009-11-25 EP disclosed
CN-101557826-A Therapeutic agent for urinary tract disease ASKA PHARM CO LTD (JP) 2009-10-14 CN disclosed
CN-101501007-A Quinazoline derivative ASKA PARMACEUTICAL CO LTD (JP) 2009-08-05 CN disclosed
EP-2050739-A1 QUINAZOLINE DERIVATIVE ASKA Pharmaceutical Co., Ltd. (JP) 2009-04-22 EP 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-20100113484-A1 TREATING AGENT OF UROPATHY BPHL, PDE12, UROD PDE5A 14/4885MMP13 378/4885KDM4E 4291/4885
US-20090318478-A1 QUINAZOLINE DERIVATIVES PDE9A, PDE3A, PDE5A PDE5A 3/4885MMP13 2568/4885KDM4E 2869/4885

“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.