SCHEMBL2008748

SCHEMBL2008748

[O-][n+]1cc(-c2ccccc2)cc2ccccc21

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.50
ATM Q13315 2/20 0.48
ALDH1A1 P00352 1/20 0.36
KDM4E B2RXH2 1/20 0.36
ESR1 P03372 2/20 0.34
ESR2 Q92731 2/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34
PGR P06401 1/20 0.33
PTGS2 P35354 1/20 0.33
BCL2 P10415 1/20 0.33
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
KMT2A Q03164 3/20 0.32
MEN1 O00255 1/20 0.32

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
SCHEMBL12275774 0.77 ATM (0.41) PARP1ATMALDH1A1ESR1ESR2
SCHEMBL5475013 0.74 NPC1 (0.54) ATMALDH1A1KDM4EESR1CA1
SCHEMBL13806417 0.73 ATM (0.50) ATMALDH1A1KDM4ENPC1RAB9A
SCHEMBL1394239 0.73 ATM (0.50) ATMALDH1A1KDM4ENPC1RAB9A
SCHEMBL2796407 0.73 ATM (0.50) ATMALDH1A1KDM4ENPC1RAB9A
SCHEMBL25413825 0.73 ATM (0.50) ATMALDH1A1KDM4ENPC1RAB9A
SCHEMBL8512795 0.73 ATM (0.50) ATMALDH1A1KDM4ENPC1RAB9A
SCHEMBL7479947 0.73 ATM (0.50) PARP1ATMALDH1A1KDM4ENPC1
SCHEMBL1285478 0.73 ATM (0.50) ATMALDH1A1KDM4ENPC1RAB9A
SCHEMBL4164409 0.73 ATM (0.50) PARP1ATMALDH1A1KDM4EESR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7960548-B2 Keratinocyte growth factor receptor—tyrosine specific inhibitors for the prevention of cancer metastatis THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 2011-06-14 US disclosed
EP-1883403-A2 KERATINOCYTE GROWTH FACTOR RECEPTOR - TYROSINE SPECIFIC INHIBITORS FOR THE PREVENTION OF CANCER METASTATIS THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 2008-02-06 EP disclosed
US-20070078176-A1 Keratinocyte growth factor receptor-tyrosine specific inhibitors for the prevention of cancer metastatis US ARMY, SECRETARY OF THE ARMY 2007-04-05 US disclosed
US-20070032518-A1 Compounds and methods of use AMGEN INC. (US) 2007-02-08 US disclosed
WO-2006119148-A2 KERATINOCYTE GROWTH FACTOR RECEPTOR - TYROSINE SPECIFIC INHIBITORS FOR THE PREVENTION OF CANCER METASTATIS THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 2006-11-09 WO disclosed
EP-1478645-A2 QUINOLINONE DERIVATIVES FOR TREATING CELL PROLIFERATION RELATED DISORDERS Amgen Inc. (US) 2004-11-24 EP disclosed
US-6822097-B1 THIAZOLE-SUBSTITUTED QUINOLINE DERIVATIVES; ANTICARCINOGENIC AGENTS, ANTISTROKE AGENTS; APOPTOSIS AND CELL PROLIFERATION TREATMENT; NERVOUS SYSTEM DISORDERS AMGEN, INC. 2004-11-23 US disclosed
WO-2003066630-A2 QUINOLINONE DERIVATIVES FOR TREATING CELL PROLIFERATION RELATED DISORDERS AMGEN INC. (US) 2003-08-14 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 (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-20070078176-A1 Keratinocyte growth factor receptor-tyrosine specific inhibitors for the prevention of cancer metastatis FGFR1, FGFR3, MET PARP1 4580/4885ATM 743/4885ALDH1A1 1697/4885
US-20070032518-A1 Compounds and methods of use BAX, BAD, CASP3 PARP1 490/4885ATM 1868/4885ALDH1A1 282/4885

“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.