SCHEMBL8895763

SCHEMBL8895763

O=C(O)c1cccc(Br)c1-c1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FABP4 P15090 4/20 0.68
▸ HNF4A P41235 1/20 0.53
▸ PRNP P04156 1/20 0.51
▸ ALDH1A1 P00352 5/20 0.50
▸ ALOX15 P16050 1/20 0.50
▸ AKR1C3 P42330 3/20 0.49
▸ AKR1C2 P52895 2/20 0.49
▸ AKR1C1 Q04828 2/20 0.49
▸ AKR1C4 P17516 1/20 0.49
▸ MAPT P10636 2/20 0.47
▸ KDM4E B2RXH2 2/20 0.47
▸ PIM1 P11309 1/20 0.47
▸ GFER P55789 1/20 0.47
▸ TDP1 Q9NUW8 1/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ LMNA P02545 1/20 0.47
▸ FABP3 P05413 2/20 0.46
▸ FABP5 Q01469 2/20 0.46
▸ CDC25B P30305 1/20 0.44
▸ ATM Q13315 1/20 0.44

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
SCHEMBL2674700 0.88 FABP4 (0.58) FABP4HNF4APRNPALDH1A1ALOX15
SCHEMBL70098 0.85 HNF4A (0.63) FABP4HNF4AALDH1A1ALOX15MAPT
SCHEMBL27950189 0.85 FABP4 (0.55) FABP4HNF4APRNPALDH1A1MAPT
SCHEMBL6536484 0.82 ALDH1A1 (0.55) FABP4HNF4APRNPALDH1A1ALOX15
SCHEMBL28549954 0.81 FABP4 (1.00) FABP4AKR1C3AKR1C2AKR1C1TDP1
SCHEMBL28391136 0.81 HNF4A (0.59) FABP4HNF4AALDH1A1ALOX15MAPT
SCHEMBL27933541 0.80 FABP4 (0.51) FABP4HNF4APRNPALDH1A1ALOX15
SCHEMBL28289664 0.80 FABP4 (0.55) FABP4ALDH1A1ALOX15MAPTKDM4E
SCHEMBL332581 0.78 ALDH1A1 (0.57) FABP4HNF4AALDH1A1ALOX15MAPT
SCHEMBL49806 0.78 ALDH1A1 (0.65) FABP4PRNPALDH1A1ALOX15AKR1C3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109678686-A A kind of preparation method of anti-hepatitis drug Lei Dipawei key intermediate 江苏工程职业技术学院 2019-04-26 — — CN claimed
CN-108373440-A A kind of preparation method of indoles and fluorenes 中节能万润股份有限公司 2018-08-07 — — CN claimed
CN-109678686-A A kind of preparation method of anti-hepatitis drug Lei Dipawei key intermediate 江苏工程职业技术学院 2019-04-26 — — CN disclosed
CN-108373440-A A kind of preparation method of indoles and fluorenes 中节能万润股份有限公司 2018-08-07 — — CN disclosed
CN-106699747-A Coumarin derivative based on thermal activation delayed fluorescence mechanism and preparation method and application thereof in organic electroluminescence devices 苏州大学 2017-05-24 — — CN disclosed
US-5626791-A FERROELECTRIC LIQUID CRYSTALS HOECHST AKTIENGESELLSCHAFT (DE) 1997-05-06 — — US disclosed
EP-0045413-A1 Flexible polyurethane foam compositions and methods for the preparation BASF WYANDOTTE CORPORATION (US) 1982-02-10 — — EP disclosed
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