SCHEMBL2844322

SCHEMBL2844322

C=CCc1ccc(OCCC(C)C)cc1OCCCC

nearest known ligand 0.58

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 3/20 0.45
CNR1 P21554 1/20 0.42
TDP1 Q9NUW8 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.40
MAPK1 P28482 2/20 0.40
MAPT P10636 2/20 0.39
LMNA P02545 1/20 0.39
HTR1B P28222 1/20 0.39
TSHR P16473 1/20 0.37

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
SCHEMBL2847329 1.00 CNR2 (0.45) CNR2CNR1TDP1L3MBTL1MAPK1
SCHEMBL2851179 0.95 TDP1 (0.41) CNR2CNR1TDP1L3MBTL1MAPK1
SCHEMBL2841499 0.95 TDP1 (0.41) CNR2CNR1TDP1L3MBTL1MAPK1
SCHEMBL2845084 0.95 TDP1 (0.45) CNR2TDP1L3MBTL1MAPK1MAPT
SCHEMBL2844531 0.91 L3MBTL1 (0.42) CNR2CNR1TDP1L3MBTL1MAPK1
SCHEMBL2841582 0.91 KDM4E (0.42) CNR2TDP1L3MBTL1MAPK1LMNA
SCHEMBL2839058 0.90 CNR2 (0.52) CNR2CNR1TDP1L3MBTL1MAPK1
SCHEMBL2844327 0.90 CNR2 (0.54) CNR2CNR1TDP1L3MBTL1MAPK1
SCHEMBL2848505 0.88 TDP1 (0.45) TDP1L3MBTL1MAPK1MAPTLMNA
SCHEMBL2848554 0.88 CNR2 (0.50) CNR2CNR1TDP1L3MBTL1MAPK1

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-9497963-B2 Methods and compositions for control of gypsy moth, Lymantria dispar SIMON FRASER UNIVERSITY (CA) 2016-11-22 US disclosed
US-9125406-B2 Methods and compositions for control of cabbage looper, trichoplusia ni SIMON FRASER UNIVERSITY (CA) 2015-09-08 US disclosed
US-20130131185-A1 Methods and Compositions for Control of Cabbage Looper, Trichoplusia ni THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2013-05-23 US disclosed
US-20130045178-A1 METHODS AND COMPOSITIONS FOR CONTROL OF GYPSY MOTH, Lymantria dispar SIMON FRASER UNIVERSITY (CA) 2013-02-21 US disclosed
US-20100297059-A1 METHODS AND COMPOSITIONS FOR CONTROL OF GYPSY MOTHS, LYMANRIA DISPAR SIMON FRASER UNIVERSITY (CA) 2010-11-25 US disclosed
US-20100190865-A1 METHODS AND COMPOSITIONS FOR CONTROL OF GYPSY MOTHS, Lymanria dispar SIMON FRASER UNIVERSITY (CA) 2010-07-29 US disclosed
US-20100160451-A1 METHODS AND COMPOSITIONS FOR CONTROL OF CABBAGE LOOPER, Trichoplusia ni SIMON FRASER UNIVERSITY (CA) 2010-06-24 US 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 (5 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-20130131185-A1 Methods and Compositions for Control of Cabbage Looper, Trichoplusia ni CDV3, ETV1, BOLA2; BOLA2B CNR2 56/4885CNR1 371/4885TDP1 3012/4885
US-20130045178-A1 METHODS AND COMPOSITIONS FOR CONTROL OF GYPSY MOTH, Lymantria dispar L3MBTL3, L3MBTL4, L3MBTL1 CNR2 332/4885CNR1 552/4885TDP1 1624/4885
US-20100190865-A1 METHODS AND COMPOSITIONS FOR CONTROL OF GYPSY MOTHS, Lymanria dispar L3MBTL3, L3MBTL4, L3MBTL1 CNR2 401/4885CNR1 701/4885TDP1 1252/4885
US-20100160451-A1 METHODS AND COMPOSITIONS FOR CONTROL OF CABBAGE LOOPER, Trichoplusia ni CDV3, ETV1, TMSB4X CNR2 53/4885CNR1 332/4885TDP1 3110/4885
US-20100297059-A1 METHODS AND COMPOSITIONS FOR CONTROL OF GYPSY MOTHS, LYMANRIA DISPAR L3MBTL3, L3MBTL4, L3MBTL1 CNR2 405/4885CNR1 686/4885TDP1 1255/4885

“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.