SCHEMBL9320124

SCHEMBL9320124

[CH2]COCC=Cc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.59
SIGMAR1 Q99720 5/20 0.45
HTR2A P28223 5/20 0.45
HTR2C P28335 4/20 0.45
HTR2B P41595 4/20 0.45
PAM P19021 1/20 0.44
MMP1 P03956 1/20 0.43
MMP2 P08253 1/20 0.43
MMP9 P14780 1/20 0.43
MMP12 P39900 1/20 0.43
DRD2 P14416 1/20 0.42
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41

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
SCHEMBL9320118 1.00 IDO1 (0.59) IDO1SIGMAR1HTR2AHTR2CHTR2B
SCHEMBL430935 0.87 IDO1 (0.68) IDO1SIGMAR1HTR2AHTR2CHTR2B
SCHEMBL430934 0.87 IDO1 (0.68) IDO1SIGMAR1HTR2AHTR2CHTR2B
SCHEMBL7514298 0.87 IDO1 (0.68) IDO1SIGMAR1HTR2AHTR2CHTR2B
SCHEMBL2146096 0.84 IDO1 (0.55) IDO1SIGMAR1HTR2AHTR2CHTR2B
SCHEMBL2146091 0.84 IDO1 (0.55) IDO1SIGMAR1HTR2AHTR2CHTR2B
SCHEMBL7254873 0.83 IDO1 (0.63) IDO1SIGMAR1HTR2AHTR2CHTR2B
SCHEMBL7254870 0.83 IDO1 (0.63) IDO1SIGMAR1HTR2AHTR2CHTR2B
SCHEMBL20127256 0.83 IDO1 (0.63) IDO1SIGMAR1HTR2AHTR2CHTR2B
SCHEMBL1158122 0.82 IDO1 (0.57) IDO1SIGMAR1HTR2AHTR2CHTR2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2014011604-A1 PHOTOCLEAVABLE BLOCK COPOLYMERS, METHODS OF MAKING AND USES THEREOF CORNELL UNIVERSITY (US) 2014-01-16 WO disclosed
EP-0464408-B1 Process for preparing star compounds SEKISUI CHEMICAL CO LTD (JP) 1994-01-12 EP disclosed
US-5102966-A Addition polymerization of unsaturated ethers using an unsaturated alkenyl polyether adduct as initiator and a cation-donating compound SEKISUI CHEMICAL CO., LTD. (JP) 1992-04-07 US disclosed
EP-0464408-A1 Process for preparing star compounds SEKISUI CHEMICAL CO., LTD. (JP) 1992-01-08 EP disclosed