SCHEMBL1064909

SCHEMBL1064909

[CH2]CCCCNCCC[CH2]

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.42
CA12 O43570 3/20 0.42
CA2 P00918 3/20 0.42
CA4 P22748 3/20 0.42
CA6 P23280 3/20 0.42
CA5A P35218 3/20 0.42
CA7 P43166 3/20 0.42
CA9 Q16790 3/20 0.42
CA14 Q9ULX7 3/20 0.42
CA5B Q9Y2D0 3/20 0.42
CYP2C19 P33261 3/20 0.42
TSHR P16473 2/20 0.42
F13A1 P00488 2/20 0.42
ALOX15 P16050 2/20 0.42
THPO P40225 2/20 0.42
MEN1 O00255 2/20 0.42
CASP2 P42575 2/20 0.42
KMT2A Q03164 2/20 0.42
ALDH1A1 P00352 1/20 0.42
RECQL P46063 1/20 0.42

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
SCHEMBL5094912 0.97 CYP1A2 (0.40) CYP1A2CA12CA2CA4CA6
SCHEMBL1230682 0.93 CYP1A2 (0.42) CYP1A2CA12CA2CA4CA6
SCHEMBL5098312 0.93 CYP1A2 (0.42) CYP1A2CA12CA2CA4CA6
SCHEMBL8764297 0.93 CYP1A2 (0.42) CYP1A2CA12CA2CA4CA6
SCHEMBL5098259 0.93 CYP1A2 (0.42) CYP1A2CA12CA2CA4CA6
SCHEMBL1066055 0.93
SCHEMBL1230675 0.87 CYP1A2 (0.38) CYP1A2CA12CA2CA4CA6
SCHEMBL4934708 0.86
SCHEMBL2488180 0.84
SCHEMBL25317055 0.82 CA12 (0.61) CYP1A2CA12CA2CA4CA6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8084596-B2 Regulated apoptosis THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2011-12-27 US disclosed
US-20110003385-A1 REGULATED TRANSCRIPTION OF TARGETED GENES AND OTHER BIOLOGICAL EVENTS PRESIDENT AND FELLOWS OF HARVARD COLLEGE 2011-01-06 US disclosed
US-20100323420-A1 REGULATED APOPTOSIS PRESIDENT AND FELLOWS OF HARVARD COLLEGE 2010-12-23 US disclosed
EP-0804561-B1 REGULATED TRANSCRIPTION OF TARGETED GENES AND OTHER BIOLOGICAL EVENTS UNIV LELAND STANFORD JUNIOR (US) 2009-12-30 EP disclosed
US-20090060888-A1 Regulated transcription of targeted genes and other biological events NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2009-03-05 US disclosed
EP-1978095-A1 Chimeric receptor proteins for controlling signal transduction and ligands binding thereto THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2008-10-08 EP disclosed
US-20060078969-A1 Regulated transcription of targeted genes and other biological events PRESIDENT AND FELLOWS OF HARVARD COLLEGE 2006-04-13 US disclosed
US-20060035325-A1 Regulated apoptosis THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2006-02-16 US disclosed
US-6972193-B1 Regulated transcription of targeted genes and other biological events BOARD OF TRUSTEES OF LELAND STANFORD JUNIOR UNIVERSITY (US) 2005-12-06 US disclosed
US-6891021-B2 Regulated apoptosis BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2005-05-10 US disclosed
US-5869337-A OLIGOMERIZES TWO OR MORE CHIMERIC PROTEIN MOLECULES TO FORM A LIGAND CROSS-LINKED PROTEIN COMPLEX PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 1999-02-09 US disclosed
US-5834266-A A GENETIC CONSTRUCT ENCODING A CHIMERIC PROTEIN HAVING AN ACTIVATABLE APOPTOSIS-DOMAIN TO COMPLEX WITH A NONPROTEIN, MEMBRANE-PERMEABLE LIGAND WHICH THEN BINDS TO ANOTHER PROTEIN THEREBY ACTIVATING THE APOPTOSIS-INDUCING DOMAIN PRESIDENT & FELLOWS OF HARVARD COLLEGE (US) 1998-11-10 US disclosed
US-5830462-A DIMERIZATION, OLIGOMERIZATION OF PROTEINS; ACTIVATION OF CELLMEMBRANE RECEPTORS PRESIDENT & FELLOWS OF HARVARD COLLEGE (US) 1998-11-03 US disclosed
EP-0776359-A4 REGULATED APOPTOSIS UNIV LELAND STANFORD JUNIOR (US) 1998-09-09 EP disclosed
EP-0804561-A1 REGULATED TRANSCRIPTION OF TARGETED GENES AND OTHER BIOLOGICAL EVENTS THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 1997-11-05 EP disclosed
EP-0776335-A1 REGULATABLE ELIMINATION OF GENE EXPRESSION, GENE PRODUCT FUNCTION AND ENGINEERED HOST CELLS ARIAD GENE THERAPEUTICS, INC. (US) 1997-06-04 EP disclosed
EP-0776359-A1 REGULATED APOPTOSIS THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 1997-06-04 EP disclosed
WO-1996006111-A1 REGULATABLE ELIMINATION OF GENE EXPRESSION, GENE PRODUCT FUNCTION AND ENGINEERED HOST CELLS ARIAD GENE THERAPEUTICS, INC. (US) 1996-02-29 WO disclosed
WO-1995002684-A1 REGULATED APOPTOSIS THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 1995-01-26 WO disclosed
WO-1994018317-A1 REGULATED TRANSCRIPTION OF TARGETED GENES AND OTHER BIOLOGICAL EVENTS THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 1994-08-18 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-20090060888-A1 Regulated transcription of targeted genes and other biological events NFATC1, CD4, ACIN1 CYP1A2 4854/4885CA12 3972/4885CA2 3546/4885
US-20060035325-A1 Regulated apoptosis BAX, CCAR2, DDIT3 CYP1A2 4822/4885CA12 4326/4885CA2 4239/4885
US-20060078969-A1 Regulated transcription of targeted genes and other biological events DGKZ, BID, TARBP1 CYP1A2 4754/4885CA12 4429/4885CA2 4067/4885

“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.