SCHEMBL3272017

SCHEMBL3272017

CC(C)NCc1ccccc1CNC(C)C

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
BCHE P06276 1/20 0.55
ACHE P22303 1/20 0.55
HRH1 P35367 1/20 0.50
LMNA P02545 1/20 0.44
CCR5 P51681 1/20 0.44
ADRA2C P18825 1/20 0.44
MPO P05164 2/20 0.43
TPO P07202 2/20 0.43
POLB P06746 1/20 0.43
MAPK1 P28482 1/20 0.43
ALDH1A1 P00352 2/20 0.42
RAB9A P51151 1/20 0.42
ATM Q13315 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
SIGMAR1 Q99720 1/20 0.40
KDM4E B2RXH2 2/20 0.39
HSD17B10 Q99714 1/20 0.39

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
SCHEMBL20630778 0.91 BCHE (0.49) BCHEACHEHRH1LMNACCR5
SCHEMBL13226832 0.91 BCHE (0.49) BCHEACHEHRH1LMNACCR5
SCHEMBL21800071 0.89 BCHE (0.47) BCHEACHEHRH1LMNACCR5
SCHEMBL26030476 0.89 BCHE (0.47) BCHEACHEHRH1LMNACCR5
SCHEMBL16363482 0.89 BCHE (0.51) BCHEACHEHRH1LMNACCR5
SCHEMBL23298422 0.89 BCHE (0.47) BCHEACHEHRH1LMNACCR5
SCHEMBL607717 0.86 ADRA2C (0.58) BCHEACHEHRH1LMNAADRA2C
SCHEMBL22548746 0.85 BCHE (0.45) BCHEACHEHRH1LMNACCR5
SCHEMBL19500161 0.85 BCHE (0.45) BCHEACHEHRH1LMNAMPO
SCHEMBL18461093 0.84 BCHE (0.47) BCHEACHEHRH1LMNACCR5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1411927-B1 METHOD FOR THE PREPARATION OF SELECTIVELY-SUBSTITUTED CORROLES AND NEW SUBSTITUTED CORROLES TECHNION RES & DEV FOUNDATION (IL) 2010-06-30 EP disclosed
US-6939963-B2 Method for the preparation of selectively-substituted corroles and new substituted corroles TECHNION RESEARCH AND DEVELOPMENT FOUNDATION LTD. (IL) 2005-09-06 US disclosed
EP-1411927-A4 METHOD FOR THE PREPARATION OF SELECTIVELY-SUBSTITUTED CORROLES AND NEW SUBSTITUTED CORROLES TECHNION RES & DEV FOUNDATION (IL) 2005-04-20 EP disclosed
US-20040180872-A1 Use as catalyst , in photovoltaic cells, drugs for diagnosis and photodynamic treatment of tumors or as chemical intermediates; metal complexes of 2,17-Bis(chlorosulfonyl)-5,10,15-tris(pentafluorophenyl)corrole TECHNION RESEARCH AND DEVELOPMENT FOUNDATION LTD. (IL) 2004-09-16 US disclosed
EP-1411927-A1 METHOD FOR THE PREPARATION OF SELECTIVELY-SUBSTITUTED CORROLES AND NEW SUBSTITUTED CORROLES Technion Research and Development Foundation Ltd. (IL) 2004-04-28 EP disclosed
WO-2003004021-A1 METHOD FOR THE PREPARATION OF SELECTIVELY-SUBSTITUTED CORROLES AND NEW SUBSTITUTED CORROLES TECHNION RESEARCH AND DEVELOPMENT FOUNDATION LTD. (IL) 2003-01-16 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-20040180872-A1 Use as catalyst , in photovoltaic cells, drugs for diagnosis and photodynamic treatment of tumors or as chemical intermediates; metal complexes of 2,17-Bis(chlorosulfonyl)-5,10,15-tris(pentafluorophenyl)corrole EPOR, NR2E3, CBR1 BCHE 3119/4885ACHE 4731/4885HRH1 814/4885

“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.