SCHEMBL10727346

SCHEMBL10727346

CNC(=O)c1c(C(O)=S)cc(C(=O)O)cc1-c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CHEK1 O14757 1/20 0.40
▸ RET P07949 1/20 0.40
▸ PDGFRB P09619 1/20 0.40
▸ PIM1 P11309 1/20 0.40
▸ PDGFRA P16234 1/20 0.40
▸ GSK3B P49841 1/20 0.40
▸ RPS6KA3 P51812 1/20 0.40
▸ LIMK1 P53667 1/20 0.40
▸ CDK5 Q00535 1/20 0.40
▸ TYRO3 Q06418 1/20 0.40
▸ MAPK14 Q16539 1/20 0.40
▸ LRRK2 Q5S007 1/20 0.40
▸ AURKB Q96GD4 1/20 0.40
▸ CLK4 Q9HAZ1 1/20 0.40
▸ DYRK1B Q9Y463 1/20 0.40
▸ PLK1 P53350 2/20 0.39
▸ ALDH1A1 P00352 3/20 0.39
▸ RAB9A P51151 3/20 0.39
▸ KMT2A Q03164 3/20 0.39
▸ MEN1 O00255 2/20 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
SCHEMBL9423207 0.74 PTPN1 (0.47) ALDH1A1KDM4EHSD17B10
SCHEMBL30883369 0.72 PTPN1 (0.46) ALDH1A1KDM4EHSD17B10
SCHEMBL7024785 0.72 TTR (0.49) ALDH1A1RAB9AKMT2AMEN1NPC1
SCHEMBL29446578 0.69 PTPN1 (0.46) HDAC7KDM4E
SCHEMBL8599779 0.68 HDAC6 (0.44) PLK1KMT2AMEN1SMN1; SMN2NEU3
SCHEMBL26925803 0.68 TPMT (0.46) ALDH1A1KMT2AMEN1MAPTSMN1; SMN2
SCHEMBL12825820 0.68 BCAT2 (0.59) CHEK1PLK1ALDH1A1RAB9AKMT2A
SCHEMBL10479912 0.67 PTPN1 (0.71) ACLYHPGDHSD17B10
SCHEMBL6262453 0.67 HNF4A (0.50) ALDH1A1KDM4EHSD17B10
SCHEMBL30763496 0.67 PTPN1 (0.71) ACLYHPGDHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4681950-A PHOTOSENSITIZERS CIBA-GEIGY CORPORATION (US) 1987-07-21 — — US disclosed
US-4585876-A PHOTOSENSITIZERS CIBA-GEIGY CORPORATION (US) 1986-04-29 — — US disclosed
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