SCHEMBL14351415

SCHEMBL14351415

CCCCCCCCCCCCCCCCCCCCc1csc(-c2sc(-c3cc(CCCCCCCCCCCCCCCCCCCC)cs3)c(N)c2N)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGS2 P35354 4/20 0.39
▸ HTR2A P28223 1/20 0.39
▸ KDM4E B2RXH2 2/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ CYP3A4 P08684 2/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ TNNC1 P63316 5/20 0.36
▸ SGPL1 O95470 1/20 0.36
▸ S1PR4 O95977 1/20 0.36
▸ S1PR1 P21453 1/20 0.36
▸ GPR183 P32249 1/20 0.36
▸ CERS2 Q96G23 1/20 0.36
▸ S1PR3 Q99500 1/20 0.36
▸ S1PR5 Q9H228 1/20 0.36
▸ ESR1 P03372 2/20 0.35
▸ ADRA2A P08913 2/20 0.35
▸ ADORA3 P0DMS8 2/20 0.35
▸ TACR2 P21452 2/20 0.35
▸ SLC6A2 P23975 2/20 0.35
▸ SLC6A4 P31645 2/20 0.35

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
SCHEMBL3555634 0.83 PTGS2 (0.48) PTGS2HTR2AKDM4ECYP3A4ALDH1A1
SCHEMBL196514 0.83 PTGS2 (0.48) PTGS2HTR2AKDM4ECYP3A4ALDH1A1
SCHEMBL1323842 0.83 PTGS2 (0.48) PTGS2HTR2AKDM4ECYP3A4ALDH1A1
SCHEMBL2012315 0.83 PTGS2 (0.48) PTGS2HTR2AKDM4ECYP3A4ALDH1A1
SCHEMBL17528636 0.82 PTGS2 (0.35) PTGS2HTR2AKDM4ECYP3A4ALDH1A1
SCHEMBL14985415 0.82 PTGS2 (0.35) PTGS2KDM4ERAB9ACYP3A4ALDH1A1
SCHEMBL15871311 0.82 PTGS2 (0.35) PTGS2KDM4ERAB9ACYP3A4ALDH1A1
SCHEMBL14985434 0.81 PTGS2 (0.36) PTGS2HTR2AKDM4ECYP3A4ALDH1A1
SCHEMBL12170136 0.79 PTGS2 (0.37) PTGS2HTR2AKDM4ECYP3A4ALDH1A1
SCHEMBL14881251 0.79 PTGS2 (0.42) PTGS2HTR2AKDM4ECYP3A4ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8779204-B2 Fluorene copolymer, method for preparation and use thereof OCEAN'S KING LIGHTING SCIENCE & TECHNOLOGY CO., LTD. (CN) 2014-07-15 — — US disclosed
EP-2562198-A1 FLUORENE COPOLYMER, METHOD FOR PREPARATION AND USE THEREOF Ocean's King Lighting Science&Technology Co., Ltd. (CN) 2013-02-27 — — EP disclosed
US-20130005932-A1 FLUORENE COPOLYMER, METHOD FOR PREPARATION AND USE THEREOF OCEAN'S KING LIGHTING SCIENCE & TECHNOLOGY CO., LTD. (CN) 2013-01-03 — — US disclosed
Send feedback