SCHEMBL7931248

SCHEMBL7931248

CCCCC(CC)COC(=O)CCc1cc(-c2nc3ccccc3s2)c(O)c(C(C)(C)C)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.42
MAPT P10636 3/20 0.40
CYP3A4 P08684 2/20 0.39
TSHR P16473 1/20 0.39
ATM Q13315 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
ALDH1A1 P00352 5/20 0.38
CA2 P00918 1/20 0.38
LMNA P02545 1/20 0.38
KDM4E B2RXH2 2/20 0.36
MAPK1 P28482 2/20 0.36
SMN1; SMN2 Q16637 5/20 0.36
RAB9A P51151 4/20 0.36
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
NPC1 O15118 3/20 0.36
PRSS1 P07477 1/20 0.35
PRSS2 P07478 1/20 0.35
PRSS3 P35030 1/20 0.35
GAA P10253 2/20 0.35

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
SCHEMBL6928491 0.90 ALDH1A1 (0.42) CYP3A4TSHRATMTDP1ALDH1A1
SCHEMBL6457663 0.86 L3MBTL1 (0.46) L3MBTL1MAPTALDH1A1KDM4EMAPK1
SCHEMBL7723145 0.82 MAPT (0.47) MAPTALDH1A1LMNAKDM4ESMN1; SMN2
SCHEMBL27558621 0.82 L3MBTL1 (0.46) L3MBTL1MAPTCYP3A4TSHRATM
SCHEMBL284444 0.81 CYP3A4 (0.56) L3MBTL1CYP3A4TSHRATMTDP1
SCHEMBL3005960 0.81 CYP3A4 (0.40) L3MBTL1CYP3A4TSHRATMTDP1
SCHEMBL77808 0.79 CYP3A4 (0.42) L3MBTL1CYP3A4TSHRATMTDP1
SCHEMBL17627924 0.78 ALDH1A1 (0.46) L3MBTL1CYP3A4TSHRATMTDP1
SCHEMBL284594 0.77 CYP3A4 (0.51) L3MBTL1CYP3A4TSHRATMTDP1
SCHEMBL4887850 0.76 CYP3A4 (0.39) L3MBTL1CYP3A4TSHRATMTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1112312-A1 POLYMER COMPOUND WITH IMPROVED GLOSS PROPERTIES Ciba SC Holding AG (CH) 2001-07-04 EP disclosed
WO-2000015708-A1 POLYMER COMPOUND WITH IMPROVED GLOSS PROPERTIES CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2000-03-23 WO disclosed
EP-0729946-B1 Condensates of butyne-linked hindered amines CIBA SC HOLDING AG (CH) 1999-12-15 EP disclosed