SCHEMBL10851841

SCHEMBL10851841

Cc1c(Cc2cccnc2)sc2ccc(C(N)=O)cc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TBXAS1 P24557 5/20 0.46
▸ F7 P08709 1/20 0.41
▸ F3 P13726 1/20 0.41
▸ SARM1 Q6SZW1 1/20 0.41
▸ SIRT2 Q8IXJ6 1/20 0.41
▸ SIRT6 Q8N6T7 1/20 0.41
▸ SIRT1 Q96EB6 1/20 0.41
▸ SIRT3 Q9NTG7 1/20 0.41
▸ SIRT5 Q9NXA8 1/20 0.41
▸ SIRT4 Q9Y6E7 1/20 0.41
▸ MKNK1 Q9BUB5 4/20 0.41
▸ MKNK2 Q9HBH9 4/20 0.41
▸ MAPT P10636 2/20 0.41
▸ RECQL P46063 2/20 0.41
▸ HPGD P15428 2/20 0.41
▸ USP2 O75604 2/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ NPSR1 Q6W5P4 2/20 0.41
▸ ALOX15 P16050 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41

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
SCHEMBL145411 0.91 TBXAS1 (0.56) TBXAS1MAPTLMNATP53
SCHEMBL10856578 0.81 TBXAS1 (0.56) TBXAS1HPGDNPSR1CYP1A2CYP3A4
SCHEMBL8595302 0.81 CLK1 (0.41) TBXAS1MAPTLMNATP53
SCHEMBL10859386 0.81 HTT (0.42) TBXAS1ALDH1A1CYP1A2CYP3A4CYP2C19
SCHEMBL10858213 0.78 AR (0.41) HPGDUSP2ALDH1A1ALOX15HSD17B10
SCHEMBL10859377 0.73 PTGFR (0.39) TBXAS1HPGDALDH1A1LMNACYP1A2
SCHEMBL7445061 0.73 F7 (0.59) TBXAS1F7F3SARM1SIRT2
SCHEMBL28309715 0.71 F7 (0.49) TBXAS1F7F3SARM1SIRT2
SCHEMBL10854472 0.71 AR (0.41) HPGDUSP2ALDH1A1ALOX15HSD17B10
SCHEMBL28246478 0.70 MKNK1 (0.52) F7F3SARM1SIRT2SIRT6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0073663-B1 THROMBOXANE SYNTHETASE INHIBITORS, PROCESSES FOR THEIR PRODUCTION, AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM Pfizer Limited (GB) 1986-06-18 — — EP disclosed
US-4590200-A NON-INHIBITION OF PROSTACYCLIN SYNTHETASE OR CYCLO-OXYGENASE PFIZER INC. (US) 1986-05-20 — — US disclosed
US-4496572-A Benzo-fused thromboxane synthetase inhibitors PFIZER INC. (US) 1985-01-29 — — US disclosed
EP-0073663-A2 Thromboxane synthetase inhibitors, processes for their production, and pharmaceutical compositions comprising them Pfizer Limited (GB) 1983-03-09 — — EP disclosed
Send feedback