SCHEMBL9850706

SCHEMBL9850706

C1=CSc2ncccc2N1

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.36
ALOX15 P16050 1/20 0.36
MAPK10 P53779 1/20 0.36
HSD17B10 Q99714 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.33
KDM4E B2RXH2 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
CYP1A2 P05177 1/20 0.30

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
SCHEMBL9586154 0.68 SMN1; SMN2 (0.33) SMN1; SMN2KDM4EGAAMAPTHPGD
SCHEMBL9099526 0.67 ALDH1A1 (0.35) ALDH1A1ALOX15MAPK10HSD17B10SMN1; SMN2
SCHEMBL2827122 0.67 ALDH1A1 (0.38) ALDH1A1ALOX15MAPK10HSD17B10SMN1; SMN2
SCHEMBL226035 0.66 GAA (0.41) ALDH1A1ALOX15GAAMAPTCYP1A2
SCHEMBL9730822 0.66 ALOX15 (0.36) ALDH1A1ALOX15MAPK10HSD17B10SMN1; SMN2
SCHEMBL6787340 0.66 SMN1; SMN2 (0.41) ALDH1A1ALOX15SMN1; SMN2KDM4EGAA
SCHEMBL31746097 0.66 SMN1; SMN2 (0.41) ALDH1A1ALOX15SMN1; SMN2KDM4EGAA
Hydrochloric Acid SCHEMBL10718549 0.64 MEN1 (0.39) ALDH1A1ALOX15GAAMAPTCYP1A2
SCHEMBL14990432 0.63
SCHEMBL6642097 0.61 NOS3 (0.30) ALDH1A1ALOX15MAPK10HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4861878-A 1H-pyrido-(2,3-b) (1,4)-thiazines BAYER AKTIENGESELLSCHAFT (DE) 1989-08-29 US claimed
EP-0226023-A1 1H-Pyrido-[2,3-b][1,4]-thiazines BAYER AG (DE) 1987-06-24 EP claimed
JP-62120389-A None JP disclosed
EP-3004118-B1 USE OF CONDENSED BENZO[B]THIAZINE DERIVATIVES AS CYTOPROTECTANTS ARANDA PHARMA LTD (FI) 2018-12-19 EP disclosed
EP-0416740-A2 Novel compounds with renin-inhibiting activity Beecham Group p.l.c. (GB) 1991-03-13 EP disclosed
US-4861878-A 1H-pyrido-(2,3-b) (1,4)-thiazines BAYER AKTIENGESELLSCHAFT (DE) 1989-08-29 US disclosed
US-4861878-A 1H-pyrido-(2,3-b) (1,4)-thiazines BAYER AKTIENGESELLSCHAFT (DE) 1989-08-29 US disclosed
EP-0226023-A1 1H-Pyrido-[2,3-b][1,4]-thiazines BAYER AG (DE) 1987-06-24 EP disclosed
EP-0226023-A1 1H-Pyrido-[2,3-b][1,4]-thiazines BAYER AG (DE) 1987-06-24 EP disclosed
EP-0226023-A1 1H-Pyrido-[2,3-b][1,4]-thiazines BAYER AG (DE) 1987-06-24 EP disclosed
JP-S62120389-A 1H-PYRIDO-(2,3-B)(1,4)-THIAZINES BAYER AG 1987-06-01 JP disclosed
EP-0216397-A2 Process for preparing imidazolinyl compounds SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1987-04-01 EP disclosed