SCHEMBL4602340

SCHEMBL4602340

COc1cc(COc2[c]cccc2)cc(OC)c1

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 5/20 0.48
MAOB P27338 9/20 0.46
PTPN1 P18031 1/20 0.41
ENPP2 Q13822 1/20 0.40
APP P05067 1/20 0.40
TSHR P16473 1/20 0.40
MAPK1 P28482 1/20 0.40
HTR1A P08908 1/20 0.38
DRD2 P14416 1/20 0.38

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
SCHEMBL28559850 0.90 MAOB (0.43) ABCB1MAOBPTPN1ENPP2HTR1A
SCHEMBL6810250 0.88 MAOB (0.55) ABCB1MAOBHTR1ADRD2
SCHEMBL2451926 0.85 APP (0.49) ABCB1MAOBAPPHTR1A
SCHEMBL10830875 0.80 TACR1 (0.41) MAOB
SCHEMBL2095414 0.78 ALDH1A1 (0.42) ABCB1TSHRMAPK1
SCHEMBL95381 0.77 TSHR (0.44) MAOBTSHRMAPK1HTR1ADRD2
SCHEMBL5672700 0.77 IDO1 (0.41) MAOB
SCHEMBL5544217 0.76 APLNR (0.46) ABCB1TSHRMAPK1
SCHEMBL28559844 0.76 MAOB (0.36) ABCB1MAOBTSHRMAPK1
SCHEMBL15389735 0.76 LOXL2 (0.50) ABCB1MAOBENPP2HTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080242662-A1 Organic Compounds NIHONYANAGI ATSUKO 2008-10-02 US claimed
EP-1915366-A2 PIPERAZINE DERIVATIVE RENIN INHIBITORS Novartis AG (CH) 2008-04-30 EP claimed
WO-2006128659-A2 PIPERAZINE DERIVATIVE RENIN INHIBITORS. NOVARTIS AG (CH) 2006-12-07 WO claimed
US-20060094715-A1 5-Ht4 receptor antagonists for the treatment of heart failure SERODUS AS (NO) 2006-05-04 US claimed
US-20080242662-A1 Organic Compounds NIHONYANAGI ATSUKO 2008-10-02 US disclosed
EP-1915366-A2 PIPERAZINE DERIVATIVE RENIN INHIBITORS Novartis AG (CH) 2008-04-30 EP disclosed
WO-2006128659-A2 PIPERAZINE DERIVATIVE RENIN INHIBITORS. NOVARTIS AG (CH) 2006-12-07 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 (1 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-20080242662-A1 Organic Compounds REN, ACE, ECE1 ABCB1 266/4885MAOB 40/4885PTPN1 4032/4885

“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.