SCHEMBL8548816

SCHEMBL8548816

Cc1nc(Sc2cc(C(=O)O)c3ccccc3n2)sc1CC(=O)O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.53
LMNA P02545 6/20 0.53
TP53 P04637 1/20 0.53
RXFP1 Q9HBX9 1/20 0.53
HPGD P15428 5/20 0.50
HTT P42858 3/20 0.50
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
KDM4E B2RXH2 7/20 0.48
MAPT P10636 2/20 0.48
ALDH1A1 P00352 2/20 0.46
USP2 O75604 1/20 0.45
ALOX15 P16050 1/20 0.45
HSD17B10 Q99714 1/20 0.45
NCOA1 Q15788 1/20 0.44
NCOA3 Q9Y6Q9 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
PDE10A Q9Y233 1/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43

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
SCHEMBL8547096 0.81 ALOX15 (0.42) POLBLMNAHPGDMEN1KMT2A
SCHEMBL8551379 0.80 KDM4E (0.49) POLBLMNATP53RXFP1HPGD
SCHEMBL4481950 0.77 PTGDR2 (0.42) POLBLMNAMEN1KMT2AKDM4E
SCHEMBL8545353 0.76 KDM4E (0.45) POLBLMNATP53HPGDKMT2A
SCHEMBL8550241 0.76 ALDH1A1 (0.50) TP53RXFP1HTTKDM4EALDH1A1
SCHEMBL8591973 0.75 ECE1 (0.42) POLBKDM4EALDH1A1ALOX15
SCHEMBL8551237 0.74 MEN1 (0.32) LMNAHPGDHTTMEN1KMT2A
SCHEMBL8591219 0.74 KDM5B (0.44) KDM4EMAPTALDH1A1SMN1; SMN2NPC1
SCHEMBL8545040 0.73 GABRP (0.39) POLBLMNAMEN1KMT2AKDM4E
SCHEMBL10689661 0.72 ALDH1A1 (0.60) POLBLMNARXFP1HPGDHTT

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
EP-0714393-B1 THIAZOLES AS ANTIVIRAL PFIZER (US) 1998-09-23 EP disclosed
US-5789408-A Antiviral thiazoles PFIZER INC. (US) 1998-08-04 US disclosed
WO-1995005378-A1 ANTIVIRAL THIAZOLES PFIZER INC. (US) 1995-02-23 WO disclosed