SCHEMBL600436

SCHEMBL600436

CCCCCn1c2ccccc2c2cc(C=O)ccc21

nearest known ligand 0.67

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 3/20 0.67
CNR2 P34972 13/20 0.60
PSEN1 P49768 2/20 0.55
PSEN2 P49810 2/20 0.55
APH1B Q8WW43 2/20 0.55
NCSTN Q92542 2/20 0.55
APH1A Q96BI3 2/20 0.55
PSENEN Q9NZ42 2/20 0.55
CNR1 P21554 1/20 0.54
PGR P06401 1/20 0.51
RORA P35398 1/20 0.51
RORC P51449 1/20 0.51
RORB Q92753 1/20 0.51
NPC1 O15118 1/20 0.51

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
SCHEMBL8701533 0.99 PTGER4 (0.66) PTGER4CNR2PSEN1PSEN2APH1B
SCHEMBL28446594 0.99 PTGER4 (0.66) PTGER4CNR2PSEN1PSEN2APH1B
SCHEMBL28217298 0.99 PTGER4 (0.66) PTGER4CNR2PSEN1PSEN2APH1B
SCHEMBL28412652 0.99 PTGER4 (0.66) PTGER4CNR2PSEN1PSEN2APH1B
SCHEMBL31174405 0.99 PTGER4 (0.66) PTGER4CNR2PSEN1PSEN2APH1B
SCHEMBL5153575 0.99 PTGER4 (0.66) PTGER4CNR2PSEN1PSEN2APH1B
SCHEMBL4821945 0.99 PTGER4 (0.66) PTGER4CNR2PSEN1PSEN2APH1B
SCHEMBL28369278 0.99 PTGER4 (0.66) PTGER4CNR2PSEN1PSEN2APH1B
SCHEMBL28142613 0.99 PTGER4 (0.66) PTGER4CNR2PSEN1PSEN2APH1B
SCHEMBL9019646 0.96 PTGER4 (0.69) PTGER4CNR2PSEN1PSEN2APH1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170096426-A1 Novel Tricyclic Modulators of Cannabinoid Receptors THE UNIV OF MONTANA (US) 2017-04-06 US disclosed
US-20170096426-A1 Novel Tricyclic Modulators of Cannabinoid Receptors THE UNIV OF MONTANA (US) 2017-04-06 US disclosed
US-20170096426-A1 Novel Tricyclic Modulators of Cannabinoid Receptors THE UNIV OF MONTANA (US) 2017-04-06 US disclosed
US-20120039804-A1 Novel Tricyclic Modulators of Cannabinoid Receptors NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2012-02-16 US disclosed
US-20120039804-A1 Novel Tricyclic Modulators of Cannabinoid Receptors NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2012-02-16 US disclosed
US-20120039804-A1 Novel Tricyclic Modulators of Cannabinoid Receptors NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2012-02-16 US disclosed
EP-1283448-B1 Electrophotographic organophotoreceptors with charge transport compounds SAMSUNG ELECTRONICS CO LTD (KR) 2008-11-05 EP disclosed
US-7358014-B2 Electrophotographic organophotoreceptors with novel charge transport compounds SAMSUNG ELECTRONICS CO., LTD. (KR) 2008-04-15 US disclosed
US-7300732-B2 Organophotoreceptors with azine-based compounds SAMSUNG ELECTRONICS CO., LTD. (KR) 2007-11-27 US disclosed
EP-1310489-B1 Electrophotographic organophotoreceptor with charge transport compounds SAMSUNG ELECTRONICS CO LTD (KR) 2006-12-13 EP disclosed
US-20050112490-A1 Electrophotographic organophotoreceptors with novel charge transport compounds SAMSUNG ELECTRONICS CO., LTD. 2005-05-26 US disclosed
US-20040219446-A1 Organophotoreceptors with azine-based compounds S-PRINTING SOLUTION CO., LTD. (KR) 2004-11-04 US disclosed
EP-1473599-A1 Organophotoreceptors with azine-based compounds Samsung Electronics Co., Ltd. (KR) 2004-11-03 EP disclosed
US-6689523-B2 CHARGE TRANSPORT COMPOUND CONTAINING BIS(3-FORMYLCARBAZOLYL)-1,1'-(SULFONYLDI-4, 1-PHENYLENE)BIS-HYDRAZONES SAMSUNG ELECTRONICS CO., LTD. (KR) 2004-02-10 US disclosed
US-20030113644-A1 Electrophotographic organophotoreceptors with novel charge transport compounds SAMSUNG ELECTRONICS CO., LTD. 2003-06-19 US disclosed
US-20030113132-A1 Electrophotographic organophotoreceptors with novel charge transport compounds SAMSUNG INFORMATION SYSTEMS AMERICA 2003-06-19 US disclosed
EP-1310489-A1 Electrophotographic organophotoreceptor with charge transport compounds Samsung Electronics Co., Ltd. (KR) 2003-05-14 EP disclosed
EP-1283448-A2 Electrophotographic organophotoreceptors with charge transport compounds Samsung Electronics Co., Ltd. (KR) 2003-02-12 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 (4 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-20120039804-A1 Novel Tricyclic Modulators of Cannabinoid Receptors CNR1, CNR2, OPRL1 PTGER4 287/4885CNR2 2/4885PSEN1 764/4885
US-20030113132-A1 Electrophotographic organophotoreceptors with novel charge transport compounds SLC43A1, SLC18A2, SLC1A1 PTGER4 3397/4885CNR2 833/4885PSEN1 4739/4885
US-20170096426-A1 Novel Tricyclic Modulators of Cannabinoid Receptors CNR1, CNR2, OPRL1 PTGER4 287/4885CNR2 2/4885PSEN1 764/4885
US-20030113644-A1 Electrophotographic organophotoreceptors with novel charge transport compounds SLC26A3, SLC43A1, SLC9A2 PTGER4 3473/4885CNR2 527/4885PSEN1 4515/4885

“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.