SCHEMBL3879583

SCHEMBL3879583

CCC1CCCCC(=O)CCCC1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TRIM24 O15164 2/20 0.48
TRIM33 Q9UPN9 2/20 0.48
ALDH1A1 P00352 1/20 0.46
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA4 P22748 1/20 0.39
HTT P42858 1/20 0.39
KMT2A Q03164 1/20 0.38
CYP1A2 P05177 1/20 0.34
NOS1 P29475 7/20 0.34
NOS2 P35228 7/20 0.34
NOS3 P29474 3/20 0.34
OPRM1 P35372 1/20 0.33
OPRL1 P41146 1/20 0.33
PDE4A P27815 3/20 0.31
PDE4B Q07343 3/20 0.31
PDE4C Q08493 3/20 0.31
PDE4D Q08499 3/20 0.31

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
SCHEMBL6242823 0.98 TRIM24 (0.50) TRIM24TRIM33ALDH1A1CA1CA2
SCHEMBL7065377 0.98 TRIM24 (0.50) TRIM24TRIM33ALDH1A1CA1CA2
SCHEMBL11796568 0.98 TRIM24 (0.50) TRIM24TRIM33ALDH1A1CA1CA2
SCHEMBL6245099 0.98 TRIM24 (0.50) TRIM24TRIM33ALDH1A1CA1CA2
SCHEMBL2692193 0.96 TRIM24 (0.43) TRIM24TRIM33ALDH1A1CA1CA2
SCHEMBL4424531 0.94 TRIM24 (0.46) TRIM24TRIM33ALDH1A1CA1CA2
SCHEMBL2692046 0.93 TRIM24 (0.43) TRIM24TRIM33ALDH1A1CA1CA2
SCHEMBL2693759 0.88 TRIM24 (0.39) TRIM24TRIM33ALDH1A1HTTNOS1
SCHEMBL2690522 0.86 TRIM24 (0.38) TRIM24TRIM33ALDH1A1CA1CA2
SCHEMBL2691711 0.85 TRIM24 (0.40) TRIM24TRIM33ALDH1A1CA1CA2

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
US-7491745-B2 Pyrrole-Type compounds, compositions and methods for treating cancer or viral disease GEMIN X PHARMACEUTICALS CANADA INC. (CA) 2009-02-17 US disclosed
US-20070037856-A1 e.g. 2-Ethyl-11-((3-methoxy-5-(1H-pyrrol-2-yl)-2H-pyrrol-2-ylidene)methyl)-10-azabicyclo[7.2.1]dodeca-9(12),11-diene; anticarcinogenic agent; antiproliferative agent, viricide GEMIN X BIOTECHNOLOGIES INC. (CA) 2007-02-15 US disclosed
EP-1431286-A2 Prodigiosin derivatives for treating cancer or viral diseases Gemin X Biotechnologies Inc. (CA) 2004-06-23 EP disclosed
US-20040014987-A1 Pyrrole-Type compounds, compositions, and methods for treating cancer or viral diseases GEMIN X BIOTECHNOLOGIES INC. 2004-01-22 US disclosed
US-6602879-B2 For inhibiting the replication or infectivity of a virus; therapy GEMIN X BIOTECHNOLOGIES INC. (CA) 2003-08-05 US disclosed
US-20030009032-A1 Pyrrole-type compounds, compositions, and methods for treating cancer or viral diseases GEMIN X PHARMACEUTICALS CANADA INC. (CA) 2003-01-09 US disclosed
EP-1255753-A2 PRODIGIOSIN-DERIVATIVES AS NEOPLASTIC AND ANTI-VIRAL AGENTS Gemin X Biotechnologies Inc. (CA) 2002-11-13 EP disclosed
US-6407244-B1 ANTIPROLIFERATIVE AGENT GEMIN X BIOTECHNOLOGIES INC. (CA) 2002-06-18 US disclosed
WO-2001055131-A2 PRODIGIOSIN-DERIVATIVES AS NEOPLASTIC AND ANTI-VIRAL AGENTS GEMIN X BIOTECHNOLOGIES INC. (CA) 2001-08-02 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 (3 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-20040014987-A1 Pyrrole-Type compounds, compositions, and methods for treating cancer or viral diseases POLI, PYCR1, ZC3HAV1 TRIM24 1078/4885TRIM33 841/4885ALDH1A1 3326/4885
US-20030009032-A1 Pyrrole-type compounds, compositions, and methods for treating cancer or viral diseases POLI, PYCR1, ZC3HAV1 TRIM24 1078/4885TRIM33 841/4885ALDH1A1 3326/4885
US-20070037856-A1 e.g. 2-Ethyl-11-((3-methoxy-5-(1H-pyrrol-2-yl)-2H-pyrrol-2-ylidene)methyl)-10-azabicyclo[7.2.1]dodeca-9(12),11-diene; anticarcinogenic agent; antiproliferative agent, viricide POLI, PCNA, ELL TRIM24 722/4885TRIM33 1839/4885ALDH1A1 2915/4885

“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.