SCHEMBL25751089

SCHEMBL25751089

Cc1ccc(-c2ccc(N3C(=O)c4ccc(Oc5ccc(C(c6ccc(Oc7ccc8c(c7)C(=O)N(C)C8=O)cc6)(C(F)(F)F)C(F)(F)F)cc5)cc4C3=O)cc2C(F)(F)F)c(C)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.41
KMT2A Q03164 7/20 0.41
MAPT P10636 3/20 0.37
NPSR1 Q6W5P4 2/20 0.37
TDP1 Q9NUW8 1/20 0.37
PKM P14618 1/20 0.37
BRD4 O60885 1/20 0.37
LPAR1 Q92633 1/20 0.36
LPAR3 Q9UBY5 1/20 0.36
ALDH1A1 P00352 4/20 0.36
GAA P10253 2/20 0.36
MCHR1 Q99705 2/20 0.35
POLB P06746 1/20 0.35
MAPK1 P28482 1/20 0.35
NPBWR1 P48145 1/20 0.34
NPC1 O15118 1/20 0.34
TSHR P16473 1/20 0.34
CASP1 P29466 1/20 0.34
RAB9A P51151 1/20 0.34
CASP7 P55210 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
SCHEMBL2600184 0.92 MEN1 (0.41) MEN1KMT2AMAPTNPSR1TDP1
SCHEMBL9927356 0.90 ALDH1A1 (0.38) MEN1KMT2AMAPTNPSR1ALDH1A1
SCHEMBL25969185 0.87 MEN1 (0.52) MEN1KMT2AMAPTNPSR1TDP1
SCHEMBL25969188 0.87 MEN1 (0.52) MEN1KMT2AMAPTNPSR1TDP1
SCHEMBL13400478 0.87 MEN1 (0.49) MEN1KMT2AMAPTNPSR1TDP1
SCHEMBL19399219 0.86 ALDH1A1 (0.39) MEN1KMT2AMAPTNPSR1ALDH1A1
SCHEMBL4549128 0.84 ALDH1A1 (0.40) MEN1KMT2AMAPTNPSR1ALDH1A1
SCHEMBL14106915 0.84 BRD4 (0.50) MEN1KMT2AMAPTNPSR1TDP1
SCHEMBL25969156 0.84 MEN1 (0.48) MEN1KMT2AMAPTNPSR1TDP1
SCHEMBL1104522 0.83 MEN1 (0.46) MEN1KMT2AMAPTNPSR1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230205031-A1 ELECTROCHROMIC COMPOSITION, ELECTROCHROMIC LAYER AND ELECTROCHROMIC DEVICE INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2023-06-29 US disclosed