SCHEMBL22701775

SCHEMBL22701775

O=C1C(=C2Sc3ccccc3S2)C(=O)N(c2ccccc2)N1c1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.37
▸ KAT2B Q92831 3/20 0.37
▸ MEN1 O00255 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ EP300 Q09472 1/20 0.37
▸ GSK3B P49841 4/20 0.36
▸ GSK3A P49840 3/20 0.36
▸ NPSR1 Q6W5P4 3/20 0.35
▸ KDM4E B2RXH2 1/20 0.34
▸ PMM2 O15305 1/20 0.34
▸ HSP90AA1 P07900 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ G6PD P11413 1/20 0.34
▸ PKM P14618 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ ALOX12 P18054 1/20 0.34
▸ MPI P34949 1/20 0.34
▸ CASP3 P42574 1/20 0.34
▸ PHOSPHO1 Q8TCT1 1/20 0.34
▸ APOBEC3G Q9HC16 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
SCHEMBL12221150 0.91 ALDH1A1 (0.36) ALDH1A1KAT2BMEN1KMT2AEP300
SCHEMBL12221147 0.80 ALDH1A1 (0.34) ALDH1A1KAT2BMEN1KMT2AEP300
SCHEMBL21185414 0.79 S100A4 (0.39) ALDH1A1MEN1KMT2ANPSR1KDM4E
SCHEMBL21788810 0.79 KMT2A (0.39) ALDH1A1KAT2BMEN1KMT2AEP300
SCHEMBL13777419 0.79 S1PR1 (0.34) ALDH1A1MEN1KMT2AGSK3BGSK3A
SCHEMBL12221148 0.76 GAA (0.40) ALDH1A1NPSR1MAPTPKMHPGD
SCHEMBL12221129 0.73 KMT2A (0.37) ALDH1A1MEN1KMT2AGSK3BNPSR1
SCHEMBL13739541 0.72 ALDH1A1 (0.57) ALDH1A1MEN1KMT2ANPSR1KDM4E
SCHEMBL14414123 0.69 MEN1 (0.41) ALDH1A1MEN1KMT2ANPSR1MAPT
SCHEMBL21191995 0.69 FAAH (0.40) ALDH1A1MEN1KMT2ANPSR1KDM4E

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
US-11829036-B2 Optically anisotropic multilayer product and method for producing same ZEON CORPORATION (JP) 2023-11-28 — — US disclosed
US-20200369958-A1 POLYMERIZABLE LIQUID CRYSTAL MATERIAL, POLYMERIZABLE LIQUID CRYSTAL COMPOSITION, POLYMER, OPTICAL FILM, OPTICALLY ANISOTROPIC BODY, POLARIZING PLATE, ANTI-REFLECTION FILM, DISPLAY DEVICE, AND METHOD OF PRODUCING POLYMERIZABLE LIQUID CRYSTAL COMPOSITION ZEON CORPORATION (JP) 2020-11-26 — — US disclosed
Send feedback