SCHEMBL27980672

SCHEMBL27980672

Cc1cc(C)c(Oc2cccc(O)c2Oc2c(C)cc(C)cc2C)c(C)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.43
▸ KDM4E B2RXH2 3/20 0.43
▸ ALDH1A1 P00352 3/20 0.43
▸ POLB P06746 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ GAA P10253 1/20 0.43
▸ APEX1 P27695 1/20 0.43
▸ MPI P34949 1/20 0.43
▸ RECQL P46063 1/20 0.43
▸ PTPN1 P18031 2/20 0.41
▸ TP53 P04637 3/20 0.38
▸ ALOX15 P16050 3/20 0.38
▸ HSD17B10 Q99714 3/20 0.38
▸ LMNA P02545 2/20 0.38
▸ HPGD P15428 2/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ ALOX12 P18054 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ TRPA1 O75762 2/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36

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
SCHEMBL31093937 0.78 MEN1 (0.46) MAPTKDM4EALDH1A1KMT2AGAA
SCHEMBL1836316 0.78 MEN1 (0.46) MAPTKDM4EALDH1A1KMT2AGAA
SCHEMBL31094006 0.76 TRPA1 (0.52) MAPTKDM4EALDH1A1POLBKMT2A
SCHEMBL1839993 0.76 TRPA1 (0.52) MAPTKDM4EALDH1A1POLBKMT2A
SCHEMBL31094038 0.75 TRPA1 (0.45) MAPTKDM4EALDH1A1KMT2AGAA
SCHEMBL1839205 0.75 TRPA1 (0.45) MAPTKDM4EALDH1A1KMT2AGAA
SCHEMBL11588960 0.75 MEN1 (0.50) MAPTALDH1A1KMT2ALMNAHPGD
Salicylic Acid SCHEMBL30887985 0.73 KDM4E (0.51) MAPTKDM4EALDH1A1KMT2ARECQL
Methyl Alcohol SCHEMBL28790286 0.73 ALDH1A1 (0.39) MAPTKDM4EALDH1A1POLBKMT2A
SCHEMBL2864860 0.73 KMT2A (0.48) MAPTKDM4EALDH1A1POLBKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115119510-A Alkylene oxide polymerization using aluminum compounds and phosphorus-nitrogen bases 陶氏环球技术有限责任公司 2022-09-27 — — CN claimed
CN-115003730-A Alkylene oxide polymerization using aluminum compounds and cyclic amidines 陶氏环球技术有限责任公司 2022-09-02 — — CN claimed
CN-115003730-A Alkylene oxide polymerization using aluminum compounds and cyclic amidines 陶氏环球技术有限责任公司 2022-09-02 — — CN disclosed
CN-102471244-B Process for producing N-substituted carbamate, process for producing isocyanate using the N-substituted carbamate, and composition for transporting and storing N-substituted carbamate containing N-substituted carbamate and aromatic hydroxy compound ASAHI CHEMICAL CORP 2014-09-24 — — CN disclosed
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