SCHEMBL8081972

SCHEMBL8081972

Cc1c(C(=O)C(F)(F)F)oc2c(Br)cccc12

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MCL1 Q07820 2/20 0.48
▸ L3MBTL1 Q9Y468 2/20 0.41
▸ HPGD P15428 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ RAB9A P51151 5/20 0.39
▸ NPC1 O15118 3/20 0.39
▸ TDP1 Q9NUW8 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.35
▸ ATM Q13315 1/20 0.35
▸ ACHE P22303 1/20 0.35
▸ LOXL2 Q9Y4K0 1/20 0.35
▸ CDC14B O60729 1/20 0.34
▸ CDC14A Q9UNH5 1/20 0.34

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
SCHEMBL24756679 0.84 RAB9A (0.54) MCL1L3MBTL1HPGDKDM4ERAB9A
SCHEMBL30136747 0.78 ALDH1A1 (0.40) MCL1L3MBTL1HPGDKDM4ERAB9A
SCHEMBL1848231 0.77 ALDH1A1 (0.46) MCL1KDM4ERAB9AALDH1A1
SCHEMBL8082611 0.75 KDM4E (0.51) MCL1L3MBTL1HPGDKDM4ERAB9A
SCHEMBL8083165 0.71 LOXL2 (0.34) MCL1LOXL2CDC14BCDC14A
SCHEMBL8082589 0.71 LOXL2 (0.32) MCL1LOXL2CDC14BCDC14A
SCHEMBL2089679 0.70 LOXL2 (0.40) MCL1L3MBTL1HPGDKDM4EALDH1A1
SCHEMBL8038421 0.70 LOXL2 (0.40) MCL1L3MBTL1HPGDKDM4EALDH1A1
SCHEMBL24756639 0.69 RAB9A (0.34) MCL1L3MBTL1HPGDKDM4ERAB9A
SCHEMBL8081887 0.67 LOXL2 (0.39) MCL1L3MBTL1HPGDKDM4ERAB9A

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-6063810-A ENANTIOMORPHS SYNTHELABO (FR) 2000-05-16 — — US disclosed
EP-0888324-A1 2-AMINOETHYL-BENZOFURAN DERIVATIVES, PREPARATION THEREOF AND THERAPEUTICAL USE THEREOF SYNTHELABO (FR) 1999-01-07 — — EP disclosed
WO-1997032870-A1 2-AMINOETHYL-BENZOFURAN DERIVATIVES, PREPARATION THEREOF AND THERAPEUTICAL USE THEREOF SYNTHELABO (FR) 1997-09-12 — — WO disclosed
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