SCHEMBL8626403

SCHEMBL8626403

O=C(O)c1cc(O)nc(S)n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 2/20 0.46
TSHR P16473 2/20 0.46
HIF1A Q16665 1/20 0.46
KDM4E B2RXH2 5/20 0.38
TDP1 Q9NUW8 2/20 0.38
ACMSD Q8TDX5 1/20 0.38
HCAR2 Q8TDS4 4/20 0.36
ALDH1A1 P00352 3/20 0.36
KDM6B O15054 1/20 0.36
TET3 O43151 1/20 0.36
KDM4A O75164 1/20 0.36
BBOX1 O75936 1/20 0.36
MAPT P10636 1/20 0.36
KDM5A P29375 1/20 0.36
KDM5C P41229 1/20 0.36
ASPH Q12797 1/20 0.36
KDM4D Q6B0I6 1/20 0.36
TET2 Q6N021 1/20 0.36
ALKBH5 Q6P6C2 1/20 0.36
KDM7A Q6ZMT4 1/20 0.36

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
SCHEMBL13651832 0.82 ALOX15 (0.50) ALOX15TSHRHIF1AKDM4ETDP1
Orotic Acid SCHEMBL185887 0.77 ALOX15 (0.50) ALOX15TSHRHIF1AKDM4ETDP1
SCHEMBL4288196 0.77 SMN1; SMN2 (0.46) ALOX15TSHRHIF1AKDM4ETDP1
SCHEMBL97719 0.75
SCHEMBL6301920 0.74 HIF1A (0.46) ALOX15TSHRHIF1AKDM4ETDP1
SCHEMBL985538 0.74 KMO (0.47) ALOX15TSHRHIF1AKDM4ETDP1
SCHEMBL8207621 0.73 MEN1 (0.30) ALDH1A1
SCHEMBL11381523 0.73 ALOX15 (0.50) ALOX15TSHRHIF1AKDM4ETDP1
Water SCHEMBL9423366 0.72 KMO (0.46) ALOX15TSHRHIF1AKDM4ETDP1
SCHEMBL29199087 0.72 ALOX15 (0.61) ALOX15TSHRHIF1AKDM4ETDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE35754-E FOR TREATING BACTERIAL INFECTIONS HOECHST AKTIENGESELLSCHAFT (DE) 1998-03-24 US disclosed
US-5710146-A ANTIBIOTICS FOR BACTERICIDES HOECHST AKTIENGESELLSCHAFT (DE) 1998-01-20 US disclosed
US-5089490-A Cephem derivatives HOECHST AKTIENGESELLSCHAFT (DE) 1992-02-18 US disclosed
US-4758556-A Cephem derivatives HOECHST AKTIENGESELLSCHAFT (DE) 1988-07-19 US disclosed
EP-0050261-B1 MOULDING MASSES STABILIZED AGAINST THERMOLYSIS WITH A LOW MONOMER CONTENT BAYER AG (DE) 1985-08-14 EP disclosed
EP-0050261-A1 Moulding masses stabilized against thermolysis with a low monomer content BAYER AG (DE) 1982-04-28 EP disclosed
US-4278793-A ANTIBIOTICS, BACTERICIDES HOECHST AKTIENGESELLSCHAFT (DE) 1981-07-14 US disclosed