SCHEMBL22323559

SCHEMBL22323559

CCCCCCCCCCCCCOP(OCCCCCCCCCCCCC)Oc1ccccc1C(C)(C)C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.44
▸ KDM4E B2RXH2 3/20 0.44
▸ NPSR1 Q6W5P4 3/20 0.40
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ GAA P10253 2/20 0.40
▸ HTT P42858 2/20 0.40
▸ TDP1 Q9NUW8 2/20 0.40
▸ LMNA P02545 3/20 0.38
▸ MAPT P10636 2/20 0.38
▸ NR1I2 O75469 1/20 0.38
▸ CHRM2 P08172 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ ADRA2A P08913 1/20 0.38
▸ OPRK1 P41145 1/20 0.38
▸ HTR2B P41595 1/20 0.38
▸ SLC6A3 Q01959 1/20 0.38
▸ HDAC6 Q9UBN7 1/20 0.38
▸ CYP1A2 P05177 2/20 0.38
▸ CYP2C19 P33261 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
SCHEMBL11428133 0.97 ALDH1A1 (0.44) ALDH1A1KDM4ENPSR1MEN1KMT2A
SCHEMBL11137750 0.87 ALDH1A1 (0.36) ALDH1A1KDM4ENPSR1MEN1KMT2A
SCHEMBL5672034 0.86 ALDH1A1 (0.45) ALDH1A1KDM4ENPSR1MEN1KMT2A
SCHEMBL21694097 0.86 ALDH1A1 (0.45) ALDH1A1KDM4ENPSR1MEN1KMT2A
SCHEMBL2882993 0.84 LMNA (0.36) ALDH1A1KDM4EMEN1KMT2ATDP1
SCHEMBL2885078 0.84 LMNA (0.36) ALDH1A1KDM4EMEN1KMT2ATDP1
SCHEMBL2184599 0.84 TSHR (0.36) ALDH1A1KDM4EGAALMNATSHR
SCHEMBL11216723 0.82 THRB (0.40) ALDH1A1NPSR1MEN1KMT2AGAA
SCHEMBL2711006 0.82 L3MBTL1 (0.45) ALDH1A1KDM4ENPSR1GAAHTT
SCHEMBL9342602 0.82 ALDH1A1 (0.41) ALDH1A1KDM4ENPSR1MEN1KMT2A

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-3921151-A1 HURRICANE-RESISTANT ACOUSTIC GLAZING Kuraray Europe GmbH (DE) 2021-12-15 — — EP disclosed
WO-2020163296-A1 HURRICANE-RESISTANT ACOUSTIC GLAZING KURARAY AMERICA, INC. (US) 2020-08-13 — — WO disclosed
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