SCHEMBL19902082

SCHEMBL19902082

Cc1ccc(NC(=O)Nc2sc3c(c2C(N)=O)CCN(CC(C)C)C3)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 2/20 0.68
KMT2A Q03164 8/20 0.61
KDM4E B2RXH2 4/20 0.61
MEN1 O00255 3/20 0.61
USP2 O75604 2/20 0.61
LMNA P02545 1/20 0.61
MAPT P10636 1/20 0.61
HTT P42858 1/20 0.61
ATM Q13315 1/20 0.61
POLB P06746 2/20 0.57
NPSR1 Q6W5P4 2/20 0.57
ALDH1A1 P00352 1/20 0.57
GAA P10253 1/20 0.57
CRHBP P24387 1/20 0.51
CRHR2 Q13324 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.50
PPARG P37231 1/20 0.49
NR2E3 Q9Y5X4 1/20 0.49
NCOR2 Q9Y618 1/20 0.49
TLR2 O60603 2/20 0.49

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
SCHEMBL17021968 0.92 KCNH2 (0.80) KCNH2KMT2AKDM4EMEN1USP2
Hydrochloric Acid SCHEMBL17006420 0.91 KCNH2 (0.81) KCNH2KMT2AKDM4EMEN1USP2
SCHEMBL17018737 0.89 KCNH2 (0.85) KCNH2KMT2AKDM4EMEN1USP2
SCHEMBL19902053 0.86 KCNH2 (0.68) KCNH2KMT2AKDM4EMEN1USP2
SCHEMBL17021994 0.86 KMT2A (0.63) KCNH2KMT2AKDM4EMEN1USP2
Hydrochloric Acid SCHEMBL17006334 0.86 KMT2A (0.65) KCNH2KMT2AKDM4EMEN1USP2
SCHEMBL19902083 0.83 KCNH2 (0.64) KCNH2KMT2AKDM4EMEN1USP2
SCHEMBL2682306 0.81 KCNH2 (1.00) KCNH2KMT2AKDM4EMEN1USP2
SCHEMBL17006343 0.80 KCNH2 (0.83) KCNH2KMT2AKDM4EMEN1USP2
SCHEMBL17018735 0.80 KCNH2 (0.83) KCNH2KMT2AKDM4EMEN1USP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9902738-B2 Compounds and methods for preventing, treating and/or protecting against sensory hair cell death UNIVERSITY OF WASHINGTON THROUGH ITS CENTER FOR COMMERCIALIZATION (US) 2018-02-27 US disclosed