SCHEMBL21545296

SCHEMBL21545296

CCCCCCCCN(CCCCCCCC)c1ccc2cc(C=Cc3cc[n+](CCCS(=O)(=O)[O-])cc3)ccc2c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4A O75164 4/20 0.49
KDM2A Q9Y2K7 4/20 0.49
CHRM2 P08172 2/20 0.47
CHRM4 P08173 2/20 0.47
CHRM5 P08912 2/20 0.47
CHRM1 P11229 2/20 0.47
CHRM3 P20309 2/20 0.47
APP P05067 3/20 0.46
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
INSR P06213 2/20 0.39
CHAT P28329 1/20 0.38
PABPC1 P11940 1/20 0.37
EIF4H Q15056 1/20 0.37
CTDSP1 Q9GZU7 1/20 0.37
HTT P42858 1/20 0.34
KDM4E B2RXH2 1/20 0.34
NPC1 O15118 1/20 0.34
MAPT P10636 1/20 0.34
THRB P10828 1/20 0.34

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
SCHEMBL29358876 1.00 KDM4A (0.49) KDM4AKDM2ACHRM2CHRM4CHRM5
SCHEMBL26962497 1.00 KDM4A (0.49) KDM4AKDM2ACHRM2CHRM4CHRM5
SCHEMBL29859878 1.00 KDM4A (0.49) KDM4AKDM2ACHRM2CHRM4CHRM5
SCHEMBL18796805 0.96 CHRM2 (0.52) KDM4AKDM2ACHRM2CHRM4CHRM5
SCHEMBL29860214 0.96 CHRM2 (0.52) KDM4AKDM2ACHRM2CHRM4CHRM5
SCHEMBL18796804 0.96 CHRM2 (0.52) KDM4AKDM2ACHRM2CHRM4CHRM5
SCHEMBL18493454 0.90 KDM4A (0.49) KDM4AKDM2ACHRM2CHRM4CHRM5
SCHEMBL18493455 0.90 KDM4A (0.49) KDM4AKDM2ACHRM2CHRM4CHRM5
SCHEMBL26643557 0.86 CHRM2 (0.52) KDM4AKDM2ACHRM2CHRM4CHRM5
SCHEMBL83585 0.86 CHRM2 (0.52) KDM4AKDM2ACHRM2CHRM4CHRM5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3568677-A1 SYSTEMS AND METHODS FOR DETECTION Photoswitch Biosciences, Inc. (US) 2019-11-20 EP claimed
US-20190346368-A1 SYSTEMS AND METHODS FOR DETECTION LUMENCOR, INC. 2019-11-14 US claimed
US-20240192138-A1 SYSTEMS AND METHODS FOR DETECTION LUMENCOR, INC. 2024-06-13 US disclosed
US-11726042-B2 Systems and methods for detection PHOTOSWITCH BIOSCIENCES, INC. (US) 2023-08-15 US disclosed
US-20220026364-A1 SYSTEMS AND METHODS FOR DETECTION LUMENCOR, INC. 2022-01-27 US disclosed
US-11041806-B2 Systems and methods for detection PHOTOSWITCH BIOSCIENCES, INC. (US) 2021-06-22 US disclosed
EP-3568677-A1 SYSTEMS AND METHODS FOR DETECTION Photoswitch Biosciences, Inc. (US) 2019-11-20 EP disclosed
US-20190346368-A1 SYSTEMS AND METHODS FOR DETECTION LUMENCOR, INC. 2019-11-14 US disclosed