SCHEMBL9575014

SCHEMBL9575014

C=COC(=O)c1c(Cl)ccc(Cl)c1C(=O)OC=C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 1/20 0.39
▸ ALDH1A1 P00352 6/20 0.38
▸ HSD17B10 Q99714 2/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ HPGD P15428 4/20 0.38
▸ TSHR P16473 3/20 0.35
▸ TAS1R3 Q7RTX0 1/20 0.35
▸ TAS1R1 Q7RTX1 1/20 0.35
▸ CYP3A4 P08684 3/20 0.34
▸ NPC1 O15118 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ CYP1A2 P05177 2/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ GSR P00390 1/20 0.32
▸ JAK2 O60674 1/20 0.31
▸ JAK1 P23458 1/20 0.31
▸ TYK2 P29597 1/20 0.31
▸ MAPT P10636 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
SCHEMBL194413 0.74 CES2 (0.52) ALDH1A1HPGDCYP3A4NPC1LMNA
SCHEMBL2538499 0.72 CES2 (0.48) ALDH1A1KDM4EHPGDTSHRNPC1
SCHEMBL295796 0.72 ALDH1A1 (0.40) ALDH1A1TSHRLMNAMAPTMEN1
SCHEMBL9313245 0.71 SMN1; SMN2 (0.53) ALDH1A1KDM4EHPGDTSHRNPC1
SCHEMBL2834918 0.71 CES2 (0.50) KDM4ELMNARAB9AJAK2JAK1
SCHEMBL8776810 0.71 MEN1 (0.35) ALDH1A1HSD17B10HPGDTSHRLMNA
SCHEMBL28944014 0.70 ALDH1A1 (0.39) ALDH1A1TSHRLMNAMAPTMEN1
SCHEMBL8776754 0.70 KLKB1 (0.41) ALDH1A1HSD17B10KDM4EHPGDTSHR
SCHEMBL28587834 0.69 DPP4 (0.35) DPP4ALDH1A1HSD17B10KDM4ETSHR
SCHEMBL15175 0.68 CYP3A4 (0.55) ALDH1A1HSD17B10KDM4ETSHRCYP3A4

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
EP-0542218-A1 Conformal coating compositions UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1993-05-19 — — EP disclosed
EP-0506088-A2 Water soluble copolymers prepared from vinyl functional monomers UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1992-09-30 — — EP disclosed
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