SCHEMBL19975253

SCHEMBL19975253

Nc1cc(S)c(N)cc1O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.41
GAA P10253 7/20 0.41
MAPT P10636 6/20 0.41
MEN1 O00255 5/20 0.41
KMT2A Q03164 5/20 0.41
KDM4E B2RXH2 4/20 0.41
PKM P14618 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
HSD17B10 Q99714 5/20 0.40
ALOX15 P16050 5/20 0.40
CYP3A4 P08684 2/20 0.40
ALOX12 P18054 3/20 0.37
HPGD P15428 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
MAPK1 P28482 1/20 0.37
POLB P06746 1/20 0.36
RAB9A P51151 1/20 0.36
HTT P42858 2/20 0.33
RECQL P46063 2/20 0.33
USP2 O75604 1/20 0.33

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
Hydrochloric Acid SCHEMBL21173925 0.97 ALDH1A1 (0.39) ALDH1A1GAAMAPTMEN1KMT2A
SCHEMBL19975207 0.89 ALDH1A1 (0.41) ALDH1A1GAAMAPTMEN1KMT2A
Hydrochloric Acid SCHEMBL21173934 0.86 ALDH1A1 (0.39) ALDH1A1GAAMAPTMEN1KMT2A
SCHEMBL18201986 0.86 ALOX15 (0.36) ALDH1A1GAAMAPTMEN1KMT2A
SCHEMBL718735 0.82 PTK2 (0.43) GAAMEN1KMT2ACYP3A4MAPK1
SCHEMBL107865 0.82 ALOX15 (0.53) ALDH1A1GAAMAPTMEN1KMT2A
Hydrochloric Acid SCHEMBL2455855 0.78 ALDH1A1 (0.50) ALDH1A1GAAMAPTMEN1KMT2A
Hydrochloric Acid SCHEMBL6674602 0.78 PTK2 (0.40) GAA
Bromide SCHEMBL11509608 0.78 ALDH1A1 (0.50) ALDH1A1GAAMAPTMEN1KMT2A
Hydrochloric Acid SCHEMBL42653 0.78 PTK2 (0.40) GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3512905-A1 METHOD FOR PRODUCING A POLYBENZAZOL POLYMER (P) BASF SE (DE) 2019-07-24 EP claimed
WO-2018050489-A1 METHOD FOR PRODUCING A POLYBENZAZOL POLYMER (P) BASF SE (DE) 2018-03-22 WO claimed
EP-3762447-A1 METHOD FOR PRODUCING FIBRES, FILMS AND MOULDED BODIES OF A POLYBENZAZOLE POLYMER (P) BASF SE (DE) 2021-01-13 EP disclosed
WO-2019170529-A1 METHOD FOR PRODUCING FIBRES, FILMS AND MOULDED BODIES OF A POLYBENZAZOLE POLYMER (P) BASF SE (DE) 2019-09-12 WO disclosed
EP-3512905-A1 METHOD FOR PRODUCING A POLYBENZAZOL POLYMER (P) BASF SE (DE) 2019-07-24 EP disclosed
WO-2018050489-A1 METHOD FOR PRODUCING A POLYBENZAZOL POLYMER (P) BASF SE (DE) 2018-03-22 WO disclosed