SCHEMBL30375768

SCHEMBL30375768

COc1ccc(S(=O)(=O)c2ccc3cnncc3c2)nc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PKM P14618 2/20 0.46
▸ HTT P42858 2/20 0.46
▸ POLB P06746 1/20 0.46
▸ MEN1 O00255 2/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ L3MBTL1 Q9Y468 2/20 0.44
▸ KDM4E B2RXH2 3/20 0.43
▸ TSHR P16473 2/20 0.43
▸ CASP1 P29466 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ AKR1B1 P15121 2/20 0.42
▸ NFE2L2 Q16236 3/20 0.41
▸ LMNA P02545 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ PLAU P00749 1/20 0.40
▸ NPC1 O15118 2/20 0.39
▸ RAB9A P51151 2/20 0.39
▸ CASP3 P42574 1/20 0.39
▸ SENP7 Q9BQF6 1/20 0.39

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
SCHEMBL5375329 0.75 CYP1A2 (0.58) KDM4ENPC1RAB9ACASP3SENP7
SCHEMBL8236987 0.72 PKM (0.63) PKMHTTPOLBMEN1KMT2A
SCHEMBL12508082 0.70 NFE2L2 (0.49) PKMHTTPOLBAKR1B1NFE2L2
SCHEMBL30375789 0.69 NAMPT (0.40) KDM4E
SCHEMBL1816343 0.69 NFE2L2 (0.51) PKMHTTPOLBAKR1B1NFE2L2
SCHEMBL4016085 0.69 MEN1 (0.57) PKMHTTMEN1KMT2AL3MBTL1
SCHEMBL3468851 0.69 NFE2L2 (0.48) PKMHTTPOLBAKR1B1NFE2L2
SCHEMBL3772670 0.69 MEN1 (0.57) PKMHTTMEN1KMT2AL3MBTL1
SCHEMBL1726389 0.69 MEN1 (0.61) PKMHTTMEN1KMT2AL3MBTL1
SCHEMBL14509008 0.68 ALDH1A1 (0.50) HTTMEN1KMT2AL3MBTL1KDM4E

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-4426681-A1 PHTHALAZINE DERIVATIVES AS PYRUVATE KINASE MODULATORS Sitryx Therapeutics Limited (GB) 2024-09-11 — — EP claimed
WO-2023079294-A1 PHTHALAZINE DERIVATIVES AS PYRUVATE KINASE MODULATORS SITRYX THERAPEUTICS LIMITED (GB) 2023-05-11 — — WO claimed
EP-4426681-A1 PHTHALAZINE DERIVATIVES AS PYRUVATE KINASE MODULATORS Sitryx Therapeutics Limited (GB) 2024-09-11 — — EP disclosed
WO-2023079294-A1 PHTHALAZINE DERIVATIVES AS PYRUVATE KINASE MODULATORS SITRYX THERAPEUTICS LIMITED (GB) 2023-05-11 — — WO disclosed
Send feedback