SCHEMBL15499127

SCHEMBL15499127

COCCOCCOCCOCCOCCOc1ccc(C(=O)c2ccc(-c3ccc(-c4ccc(-c5ccc(C(F)(F)F)cc5)c(OC)c4)cc3OC)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.49
▸ HTT P42858 2/20 0.49
▸ KMT2A Q03164 1/20 0.49
▸ AKR1C3 P42330 1/20 0.47
▸ AKR1C2 P52895 1/20 0.47
▸ ALDH1A1 P00352 2/20 0.44
▸ HPGD P15428 2/20 0.44
▸ MAPT P10636 4/20 0.44
▸ LMNA P02545 2/20 0.44
▸ L3MBTL1 Q9Y468 2/20 0.44
▸ PTGDR2 Q9Y5Y4 1/20 0.43
▸ CYP1A1 P04798 2/20 0.43
▸ CYP1B1 Q16678 2/20 0.43
▸ RARG P13631 1/20 0.42
▸ MCHR1 Q99705 1/20 0.42
▸ ROCK2 O75116 1/20 0.42
▸ ROCK1 Q13464 1/20 0.42
▸ CHEK2 O96017 1/20 0.41
▸ GPBAR1 Q8TDU6 1/20 0.41
▸ P2RY14 Q15391 1/20 0.41

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
SCHEMBL15499129 0.91 AKR1C3 (0.44) KDM4EHTTKMT2AAKR1C3AKR1C2
SCHEMBL15496875 0.87 ALDH1A1 (0.50) KDM4EALDH1A1HPGDMAPTLMNA
SCHEMBL15499148 0.87 KDM4E (0.50) KDM4EHTTKMT2AALDH1A1HPGD
SCHEMBL15499140 0.84 MAPT (0.48) KDM4EALDH1A1HPGDMAPTLMNA
SCHEMBL15496880 0.84 LMNA (0.48) KDM4EALDH1A1HPGDMAPTLMNA
SCHEMBL15496887 0.82 MAPT (0.48) KDM4EALDH1A1HPGDMAPTLMNA
SCHEMBL15499131 0.82 MCHR1 (0.43) KDM4EHTTKMT2AAKR1C3AKR1C2
SCHEMBL15499128 0.81 AKR1C3 (0.42) KDM4EHTTKMT2AAKR1C3AKR1C2
SCHEMBL15496873 0.78 LMNA (0.45) KDM4EKMT2AALDH1A1HPGDMAPT
SCHEMBL15499130 0.77 AKR1C3 (0.47) KDM4EAKR1C3AKR1C2ALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140064053-A1 NON-RESONANT TWO-PHOTON ABSORPTION MATERIAL, NON-RESONANT TWO-PHOTON ABSORPTION RECORDING MATERIAL, RECORDING MEDIUM, RECORDING/REPRODUCING METHOD AND NON-RESONANT TWO-PHOTON ABSORPTION COMPOUND FUJIFILM CORPORATION (JP) 2014-03-06 — — US disclosed
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