SCHEMBL17694531

SCHEMBL17694531

CCC(C)C(=O)OCCCCOc1ccc(N=Nc2ccc(N(CC)CC)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PPARA Q07869 3/20 0.40
▸ MAPT P10636 4/20 0.40
▸ TDP1 Q9NUW8 3/20 0.40
▸ KDM4E B2RXH2 2/20 0.40
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ HTT P42858 2/20 0.39
▸ MAPK1 P28482 2/20 0.39
▸ GSK3B P49841 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ NOX1 Q9Y5S8 1/20 0.38
▸ HRH3 Q9Y5N1 1/20 0.37
▸ POLB P06746 1/20 0.37
▸ PPARG P37231 2/20 0.36
▸ PPARD Q03181 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL17694528 0.92 PRSS1 (0.47) MAPTMEN1KMT2ANPC1LMNA
SCHEMBL17694530 0.92 PRSS1 (0.47) MAPTMEN1KMT2ANPC1LMNA
SCHEMBL17131749 0.92 PRSS1 (0.47) MAPTMEN1KMT2ANPC1LMNA
SCHEMBL26033899 0.91 PRSS1 (0.47) MAPTMEN1KMT2ANPC1LMNA
SCHEMBL25491753 0.90 HTT (0.45) PPARAMAPTKMT2ANPC1RAB9A
SCHEMBL25491694 0.90 HTT (0.45) PPARAMAPTKMT2ANPC1RAB9A
SCHEMBL19267591 0.86 PPARA (0.44) PPARAMAPTTDP1KDM4EMEN1
SCHEMBL18948057 0.85 PPARA (0.43) PPARAMAPTTDP1KDM4EMEN1
SCHEMBL23784437 0.85 PPARA (0.46) PPARAMAPTTDP1KDM4EMEN1
SCHEMBL23996298 0.85 HTT (0.36) PPARAMAPTTDP1KDM4EMEN1

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
US-20170242175-A1 RETARDATION FILM, COMPOSITION, METHOD OF MANUFACTURING RETARDATION FILM, POLARIZING PLATE AND LIQUID CRYSTAL DISPLAY DEVICE FUJIFILM CORPORATION (JP) 2017-08-24 — — US disclosed
US-9678384-B2 Retardation film, composition, method of manufacturing retardation film, polarizing plate and liquid crystal display device FUJIFILM CORPORATION (JP) 2017-06-13 — — US disclosed
US-20160109757-A1 RETARDATION FILM, COMPOSITION, METHOD OF MANUFACTURING RETARDATION FILM, POLARIZING PLATE AND LIQUID CRYSTAL DISPLAY DEVICE FUJIFILM CORPORATION (JP) 2016-04-21 — — US disclosed
Send feedback