SCHEMBL28098717

SCHEMBL28098717

C=Cc1cccc(OCCCCCCCCCCCC)c1C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MCHR1 Q99705 2/20 0.43
▸ LMNA P02545 2/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ NR1I2 O75469 1/20 0.43
▸ CHRM2 P08172 1/20 0.43
▸ CYP3A4 P08684 1/20 0.43
▸ ADRA2A P08913 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ OPRK1 P41145 1/20 0.43
▸ HTR2B P41595 1/20 0.43
▸ SLC6A3 Q01959 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ HDAC6 Q9UBN7 1/20 0.43
▸ CYP1A2 P05177 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ TSHR P16473 2/20 0.40
▸ ALDH1A1 P00352 3/20 0.39
▸ HTT P42858 1/20 0.39
▸ PPARG P37231 2/20 0.38

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
SCHEMBL16958262 0.89 HTR1B (0.40) MCHR1LMNAMEN1CHRM2MAPT
SCHEMBL28035361 0.87 KMT2A (0.51) MCHR1LMNAMEN1NR1I2CHRM2
SCHEMBL27725979 0.87 KMT2A (0.51) MCHR1LMNAMEN1NR1I2CHRM2
SCHEMBL28034884 0.87 KMT2A (0.51) MCHR1LMNAMEN1NR1I2CHRM2
SCHEMBL5562266 0.87 KMT2A (0.51) MCHR1LMNAMEN1NR1I2CHRM2
SCHEMBL7535277 0.87 KMT2A (0.51) MCHR1LMNAMEN1NR1I2CHRM2
SCHEMBL28035375 0.87 KMT2A (0.51) MCHR1LMNAMEN1NR1I2CHRM2
SCHEMBL2097272 0.87 KMT2A (0.51) MCHR1LMNAMEN1NR1I2CHRM2
SCHEMBL7540395 0.87 KMT2A (0.51) MCHR1LMNAMEN1NR1I2CHRM2
SCHEMBL28034882 0.87 KMT2A (0.51) MCHR1LMNAMEN1NR1I2CHRM2

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
CN-105873968-B Block copolymer 株式会社LG化学 2018-09-28 — — CN disclosed
CN-105873968-A Block copolymer 株式会社LG化学 2016-08-17 — — CN disclosed
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