SCHEMBL2706604

SCHEMBL2706604

BrCc1ccc2c(Br)cccc2n1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 1/20 0.56
GRM5 P41594 1/20 0.44
KCNH2 Q12809 1/20 0.44
CCR1 P32246 1/20 0.42
ELANE P08246 2/20 0.39
C1R P00736 2/20 0.36
KMT2A Q03164 1/20 0.36
CYP1A2 P05177 1/20 0.35
TYMS P04818 2/20 0.33
CYSLTR2 Q9NS75 1/20 0.33
CYSLTR1 Q9Y271 1/20 0.33
NOS1 P29475 1/20 0.32
AXL P30530 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
GAA P10253 1/20 0.32
HPGD P15428 1/20 0.32
GUSB P08236 1/20 0.32
CDK9 P50750 1/20 0.32
DYRK1A Q13627 1/20 0.32

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
SCHEMBL29923487 0.83 BACE1 (0.55) BACE1GRM5KCNH2ELANEC1R
SCHEMBL24695125 0.83 BACE1 (0.55) BACE1GRM5KCNH2ELANEC1R
SCHEMBL12433302 0.83 BACE1 (0.55) BACE1GRM5KCNH2ELANEC1R
SCHEMBL4307906 0.79 PDE10A (0.44) BACE1CCR1ELANEC1RTYMS
SCHEMBL29518294 0.79 CCR1 (0.41) BACE1CCR1ELANEC1RKMT2A
SCHEMBL203015 0.79 ELANE (0.44) BACE1CCR1ELANECYP1A2KDM4E
SCHEMBL12152293 0.79 KCNH2 (0.57) BACE1KCNH2KDM4EALDH1A1GAA
SCHEMBL3926944 0.77 ELANE (0.42) BACE1KCNH2CCR1ELANEC1R
SCHEMBL31434331 0.76 BACE1 (0.51) BACE1GRM5KCNH2CYP1A2TYMS
SCHEMBL28415013 0.75 BACE1 (0.64) BACE1GRM5KCNH2C1RKMT2A

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-20250179008-A1 ANTIBACTERIAL AGENTS TAXIS PHARMACEUTICALS, INC. (US) 2025-06-05 US disclosed
US-20150191420-A1 ANTIBACTERIAL AGENTS TAXIS PHARMACEUTICALS, INC. 2015-07-09 US disclosed
US-20150191420-A1 ANTIBACTERIAL AGENTS TAXIS PHARMACEUTICALS, INC. 2015-07-09 US disclosed
US-20150191420-A1 ANTIBACTERIAL AGENTS TAXIS PHARMACEUTICALS, INC. 2015-07-09 US disclosed
US-8865736-B2 Antibacterial agents Biota Scientific Pty Ltd (AU) 2014-10-21 US disclosed
US-8865736-B2 Antibacterial agents Biota Scientific Pty Ltd (AU) 2014-10-21 US disclosed
US-8865736-B2 Antibacterial agents Biota Scientific Pty Ltd (AU) 2014-10-21 US disclosed
US-20130072520-A2 ANTIBACTERIAL AGENTS BIOTA SCIENTIFIC MANAGEMENT PTY LTD (AU) 2013-03-21 US disclosed
US-20130072520-A2 ANTIBACTERIAL AGENTS BIOTA SCIENTIFIC MANAGEMENT PTY LTD (AU) 2013-03-21 US disclosed
US-20130072520-A2 ANTIBACTERIAL AGENTS BIOTA SCIENTIFIC MANAGEMENT PTY LTD (AU) 2013-03-21 US disclosed
US-20120122918-A1 ANTIBACTERIAL AGENTS BIOTA SCIENTIFIC MANAGEMENT PTY LTD (AU) 2012-05-17 US disclosed
US-20120122918-A1 ANTIBACTERIAL AGENTS BIOTA SCIENTIFIC MANAGEMENT PTY LTD (AU) 2012-05-17 US disclosed
US-20120122918-A1 ANTIBACTERIAL AGENTS BIOTA SCIENTIFIC MANAGEMENT PTY LTD (AU) 2012-05-17 US disclosed
US-8088791-B2 Antibacterial agents Biots Scientific Management Pty Ltd (AU) 2012-01-03 US disclosed
US-8088791-B2 Antibacterial agents Biots Scientific Management Pty Ltd (AU) 2012-01-03 US disclosed
US-20100173933-A1 ANTIBACTERIAL AGENTS PROLYSIS LTD (GB) 2010-07-08 US disclosed
US-20100173933-A1 ANTIBACTERIAL AGENTS PROLYSIS LTD (GB) 2010-07-08 US disclosed
WO-2007107758-A1 ANTIBACTERIAL AGENTS PROLYSIS LTD (GB) 2007-09-27 WO 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-20120122918-A1 ANTIBACTERIAL AGENTS ALK, ROS1, ARG1 BACE1 2803/4885GRM5 4700/4885KCNH2 191/4885
US-20130072520-A2 ANTIBACTERIAL AGENTS ALK, ROS1, NOX1 BACE1 2108/4885GRM5 4712/4885KCNH2 296/4885
US-20150191420-A1 ANTIBACTERIAL AGENTS ALK, ARG1, ROS1 BACE1 2957/4885GRM5 4718/4885KCNH2 143/4885
US-20250179008-A1 ANTIBACTERIAL AGENTS ALK, ROS1, NOX1 BACE1 2108/4885GRM5 4712/4885KCNH2 296/4885
US-20100173933-A1 ANTIBACTERIAL AGENTS ALK, ROS1, NOX1 BACE1 2108/4885GRM5 4712/4885KCNH2 296/4885

“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.