SCHEMBL28557543

SCHEMBL28557543

CCCCCC(=Nc1ccccc1)c1ccccc1C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ RECQL P46063 1/20 0.49
▸ KMT2A Q03164 1/20 0.49
▸ ALDH1A1 P00352 2/20 0.45
▸ CES2 O00748 2/20 0.44
▸ CES1 P23141 2/20 0.44
▸ TSHR P16473 2/20 0.43
▸ CA12 O43570 2/20 0.43
▸ CA9 Q16790 2/20 0.43
▸ ALOX15 P16050 1/20 0.42
▸ TP53 P04637 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ MGLL Q99685 1/20 0.40
▸ EPHX2 P34913 1/20 0.40

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
SCHEMBL29000336 0.98 KDM4E (0.48) KDM4EMEN1RECQLKMT2AALDH1A1
SCHEMBL28552975 0.95 KDM4E (0.54) KDM4EMEN1RECQLKMT2AALDH1A1
SCHEMBL28549159 0.89 ALDH1A1 (0.47) KDM4EMEN1RECQLKMT2AALDH1A1
SCHEMBL28553874 0.82 ALDH1A1 (0.50) KDM4EMEN1RECQLKMT2AALDH1A1
SCHEMBL28556935 0.82 KDM4E (0.44) KDM4EMEN1RECQLKMT2AALDH1A1
SCHEMBL29049816 0.81 KDM4E (0.43) KDM4EMEN1RECQLKMT2AALDH1A1
Phthalic Acid SCHEMBL6568928 0.79 AKR1B1 (0.61) KDM4EMEN1RECQLKMT2AALDH1A1
Phthalic Acid SCHEMBL28653607 0.78 ALDH1A1 (0.64) KDM4EMEN1RECQLKMT2AALDH1A1
Phthalic Acid SCHEMBL29793929 0.78 ALDH1A1 (0.64) KDM4EMEN1RECQLKMT2AALDH1A1
Phthalic Acid SCHEMBL28601357 0.78 ALDH1A1 (0.64) KDM4EMEN1RECQLKMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112759672-B Solid catalyst component for olefin polymerization, catalyst and application thereof 中国石油化工股份有限公司 2023-04-11 — — CN disclosed
CN-112759528-A Novel imidate compound and preparation method thereof 中国石油化工股份有限公司 2021-05-07 — — CN disclosed
CN-112759672-A Solid catalyst component for olefin polymerization, catalyst and application thereof 中国石油化工股份有限公司 2021-05-07 — — CN disclosed
CN-112759677-A Solid catalyst component for olefin polymerization, catalyst and application thereof 中国石油化工股份有限公司 2021-05-07 — — CN disclosed
CN-112759676-A Solid catalyst component for preparing polyolefin, catalyst and application thereof 中国石油化工股份有限公司 2021-05-07 — — CN disclosed
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