SCHEMBL15364446

SCHEMBL15364446

C(=C(c1ccccc1)c1ccccc1)P(C1CCCC1)C1CCCC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 1/20 0.37
MTNR1B P49286 1/20 0.37
CHRNB2 P17787 1/20 0.36
CHRNB4 P30926 1/20 0.36
CHRNA3 P32297 1/20 0.36
CHRNA4 P43681 1/20 0.36
MCL1 Q07820 1/20 0.36
CHRM3 P20309 1/20 0.36
SIGMAR1 Q99720 2/20 0.34
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
ALDH1A1 P00352 4/20 0.33
SLC6A1 P30531 2/20 0.33
CYP1A2 P05177 2/20 0.33
CYP2C9 P11712 2/20 0.33
CYP2C19 P33261 2/20 0.33
LMNA P02545 2/20 0.33
CYP2D6 P10635 1/20 0.33
TSHR P16473 1/20 0.33
NFKB1 P19838 1/20 0.33

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
SCHEMBL15364811 0.98 CHRNB2 (0.39) MTNR1AMTNR1BCHRNB2CHRNB4CHRNA3
SCHEMBL15527706 0.80 KDM1A (0.41) MCL1NPC1RAB9AALDH1A1CYP1A2
SCHEMBL15364236 0.74 GRM5 (0.43) NPC1RAB9AALDH1A1CYP1A2LMNA
Hydrochloric Acid SCHEMBL1195678 0.69 CHRNB2 (0.34) MTNR1AMTNR1BCHRNB2CHRNB4CHRNA3
Acetophenone SCHEMBL22534399 0.68 ALDH1A1 (0.40) MCL1NPC1RAB9AALDH1A1CYP1A2
SCHEMBL15364307 0.67 MTNR1A (0.40) MTNR1AMTNR1BCHRNB2CHRNB4CHRNA3
SCHEMBL15364557 0.67 HSP90AA1 (0.40) GAA
SCHEMBL15364554 0.67 HSP90AA1 (0.40) GAA
SCHEMBL15364521 0.66 ALDH1A1 (0.39) MTNR1AMTNR1BALDH1A1CYP1A2CYP2C9
SCHEMBL15364968 0.65 CHRNB2 (0.47) CHRNB2CHRNB4CHRNA3CHRNA4SIGMAR1

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-9868805-B2 Polydienes and diene copolymers having organophosphine functionality BRIDGESTONE CORPORATION (JP) 2018-01-16 US disclosed
EP-2844678-B1 POLYDIENES AND DIENE COPOLYMERS HAVING ORGANOPHOSPHINE FUNCTIONALITY BRIDGESTONE CORP (JP) 2017-02-22 EP disclosed
US-9499651-B2 Copolymers of conjugated dienes and vinyl organophosphines prepared by anionic polymerization BRIDGESTONE CORPORATION (JP) 2016-11-22 US disclosed
US-9127109-B2 Preparation of functional polymers phosphorus-containing organometal initiators BRIDGESTONE CORPORATION (JP) 2015-09-08 US disclosed
US-20150126675-A1 Polydienes And Diene Copolymers Having Organophosphine Functionality BRIDGESTONE CORPORATION (JO) 2015-05-07 US disclosed
EP-2844678-A1 POLYDIENES AND DIENE COPOLYMERS HAVING ORGANOPHOSPHINE FUNCTIONALITY Bridgestone Corporation (JP) 2015-03-11 EP disclosed
US-20140275428-A1 Copolymers Of Conjugated Dienes And Vinyl Organophosphines Prepared By Anionic Polymerization BRIDGESTONE CORPORATION (JP) 2014-09-18 US disclosed
WO-2013166124-A1 POLYDIENES AND DIENE COPOLYMERS HAVING ORGANOPHOSPHINE FUNCTIONALITY BRIDGESTONE CORPORATION (JP) 2013-11-07 WO disclosed
US-20130296480-A1 PREPARATION OF FUNCTIONAL POLYMERS PHOSPHORUS-CONTAINING ORGANOMETAL INITIATORS BRIDGESTONE CORPORATION (JP) 2013-11-07 US disclosed