SCHEMBL24909384

SCHEMBL24909384

CCN(C(=O)C(Cc1ccccc1)N1C(=O)c2cc(Oc3ccccc3C)c3c4c(Oc5ccccc5C)cc5c6c(cc(Oc7ccccc7C)c(c7c(Oc8ccccc8C)cc(c2c37)C1=O)c64)C(=O)N(C(Cc1ccccc1)C(=O)N(CC)c1ccncc1)C5=O)c1ccncc1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.43
TSHR P16473 1/20 0.43
GAA P10253 1/20 0.39
AADAT Q8N5Z0 1/20 0.37
HSD11B1 P28845 1/20 0.36
HPGD P15428 1/20 0.36
DUSP3 P51452 1/20 0.36
PTPN5 P54829 1/20 0.36
PTPN11 Q06124 1/20 0.36
POLB P06746 3/20 0.36
L3MBTL1 Q9Y468 3/20 0.36
KMT2A Q03164 1/20 0.36
PKM P14618 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
MAPT P10636 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
MAPK14 Q16539 1/20 0.33

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
SCHEMBL24908972 0.86 ALDH1A1 (0.37) ALDH1A1TSHRHSD11B1POLBKMT2A
SCHEMBL24909280 0.84 ALDH1A1 (0.39) ALDH1A1TSHRGAAAADATHSD11B1
SCHEMBL24909348 0.84 ALDH1A1 (0.39) ALDH1A1TSHRGAAAADATHSD11B1
SCHEMBL24909207 0.83 NOTUM (0.32) ALDH1A1L3MBTL1KMT2ASMN1; SMN2NPSR1
SCHEMBL24908742 0.83 HSD11B1 (0.45) ALDH1A1TSHRGAAAADATHSD11B1
SCHEMBL24908695 0.81 NPC1 (0.32)
SCHEMBL24908710 0.79 POLB (0.37) ALDH1A1TSHRGAAPOLBL3MBTL1
SCHEMBL24909613 0.77 NOTUM (0.34) ALDH1A1TSHRHPGDPOLBL3MBTL1
SCHEMBL24909032 0.76 KMT2A (0.42) ALDH1A1TSHRGAAAADATHSD11B1
SCHEMBL24909125 0.76 TSHR (0.47) ALDH1A1TSHRGAAAADATHSD11B1

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-20230023648-A1 COMPOUND, PHOTOSENSITIVE FLUORESCENT RESIN COMPOSITION COMPRISING SAME, COLOR CONVERSION FILM PREPARED USING SAME, BACKLIGHT UNIT, AND DISPLAY DEVICE LG CHEM, LTD (KR) 2023-01-26 US disclosed
US-9624160-B2 Reactive ionic liquids BASF SE (DE) 2017-04-18 US disclosed