SCHEMBL209552

SCHEMBL209552

Fc1ccc2c[c]cnc2c1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 2/20 0.40
PDGFRA P16234 2/20 0.40
KDM4E B2RXH2 1/20 0.37
BACE1 P56817 1/20 0.37
KMT2A Q03164 1/20 0.36
CYP1A2 P05177 1/20 0.35
CYP2A6 P11509 1/20 0.35
AXL P30530 1/20 0.32
GFER P55789 1/20 0.32
AHR P35869 1/20 0.31
MAPT P10636 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
CASP3 P42574 1/20 0.31
SENP8 Q96LD8 1/20 0.31
SENP7 Q9BQF6 1/20 0.31
SENP6 Q9GZR1 1/20 0.31
PARP1 P09874 1/20 0.30

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
SCHEMBL27689439 0.85 PDGFRB (0.39) PDGFRBPDGFRA
SCHEMBL208132 0.84 BACE1 (0.41) KDM4EBACE1KMT2ACYP1A2CYP2A6
SCHEMBL5748176 0.78 ALDH1A1 (0.52) KDM4EBACE1KMT2ACYP1A2CYP2A6
SCHEMBL207927 0.76 NR4A2 (0.50) PDGFRBPDGFRAKDM4EKMT2ACYP1A2
SCHEMBL209087 0.76 HTT (0.50) KDM4EBACE1KMT2ACYP1A2CYP2A6
SCHEMBL3389355 0.76 ALDH1A1 (0.50) PDGFRBPDGFRAKDM4EKMT2ACYP1A2
SCHEMBL2902398 0.76 BACE1 (0.42) KDM4EBACE1KMT2APARP1
SCHEMBL6694667 0.75 PDGFRB (0.35) PDGFRBPDGFRA
SCHEMBL5748301 0.73 HPGDS (0.38) KDM4ECYP2A6
SCHEMBL3224574 0.72 NPC1 (0.41) CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1577301-B1 Antithrombotic diaminocyclohexane derivatives DAIICHI SANKYO CO LTD (JP) 2012-09-12 EP claimed
EP-1270557-B1 ETHYLENEDIAMINE DERIVATIVES DAIICHI SANKYO CO LTD (JP) 2012-07-25 EP claimed
US-20090239857-A1 TRIAMINE DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2009-09-24 US claimed
US-7576135-B2 Diamine derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2009-08-18 US claimed
EP-1864982-A1 TRIAMINE DERIVATIVE DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2007-12-12 EP claimed
US-20070129371-A1 Novel ethylenediamine derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2007-06-07 US claimed
US-7192968-B2 Ethylenediamine derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2007-03-20 US claimed
US-20060252837-A1 Cyclic diamine derivatives useful as agents for preventing and/or treating cerebral infarction, cerebral embolism, myocardial infarction, angina pectoris, pulmonary infarction, pulmonary embolism; inhibit activated blood coagulation factor X DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2006-11-09 US claimed
US-20050245565-A1 Diamine derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2005-11-03 US claimed
EP-1577301-A1 DIAMINE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2005-09-21 EP claimed
EP-1577302-A1 NOVEL ETHYLENEDIAMINE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2005-09-21 EP claimed
US-20050119486-A1 Diamine derivatives DAIICHI SANKYO COMPANY, LIMITED (JP) 2005-06-02 US claimed
US-20050020645-A1 Diamine derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2005-01-27 US claimed
US-20040122063-A1 Ethylenediamine derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2004-06-24 US claimed
EP-1415992-A1 DIAMINE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2004-05-06 EP claimed
EP-1405852-A1 DIAMINE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2004-04-07 EP claimed
EP-1270557-A1 ETHYLENEDIAMINE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2003-01-02 EP claimed
US-20240199604-A1 SUPRAMOLECULAR POLYMER THERAPEUTICS AND DIAGNOSTICS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2024-06-20 US disclosed
EP-1405852-A1 DIAMINE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2004-04-07 EP disclosed
EP-1270557-A1 ETHYLENEDIAMINE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2003-01-02 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 (8 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-20240199604-A1 SUPRAMOLECULAR POLYMER THERAPEUTICS AND DIAGNOSTICS MAPT, HTT, PSEN1 PDGFRB 4096/4885PDGFRA 3937/4885KDM4E 4298/4885
US-20070129371-A1 Novel ethylenediamine derivatives C1R, C9, C1S PDGFRB 1948/4885PDGFRA 2189/4885KDM4E 3425/4885
US-20090239857-A1 TRIAMINE DERIVATIVE F2, F12, F3 PDGFRB 179/4885PDGFRA 60/4885KDM4E 2715/4885
US-20060252837-A1 Cyclic diamine derivatives useful as agents for preventing and/or treating cerebral infarction, cerebral embolism, myocardial infarction, angina pectoris, pulmonary infarction, pulmonary embolism; inhibit activated blood coagulation factor X F2, C1S, C9 PDGFRB 2989/4885PDGFRA 2476/4885KDM4E 3761/4885
US-20050020645-A1 Diamine derivatives C9, C1S, C1R PDGFRB 3607/4885PDGFRA 3407/4885KDM4E 3971/4885
US-20050245565-A1 Diamine derivatives C9, C1S, C1R PDGFRB 3607/4885PDGFRA 3407/4885KDM4E 3971/4885
US-20050119486-A1 Diamine derivatives C9, C1S, C1R PDGFRB 3607/4885PDGFRA 3407/4885KDM4E 3971/4885
US-20040122063-A1 Ethylenediamine derivatives ECE1, F2, ECE2 PDGFRB 3355/4885PDGFRA 3081/4885KDM4E 645/4885

“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.