SCHEMBL25028232

SCHEMBL25028232

Clc1ccc(-c2nc3cc4sc(-c5ccc(Cl)cn5)nc4cc3s2)nc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.41
MGAM O43451 1/20 0.41
SI P14410 1/20 0.41
MGAM2 Q2M2H8 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
KDM4E B2RXH2 3/20 0.41
NPC1 O15118 3/20 0.41
ALDH1A1 P00352 3/20 0.41
RAB9A P51151 3/20 0.41
TP53 P04637 1/20 0.41
TSHR P16473 1/20 0.41
HSD17B10 Q99714 1/20 0.41
APP P05067 2/20 0.41
NPSR1 Q6W5P4 1/20 0.39
LOXL2 Q9Y4K0 1/20 0.39
IDO1 P14902 1/20 0.39
F2RL3 Q96RI0 1/20 0.39
HTT P42858 2/20 0.38
ILK Q13418 1/20 0.37
MEN1 O00255 2/20 0.37

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
SCHEMBL24156046 0.85 RAB9A (0.60) GAASMN1; SMN2KDM4ENPC1ALDH1A1
SCHEMBL1736048 0.80 APP (0.49) GAAMGAMSIMGAM2SMN1; SMN2
SCHEMBL23954413 0.79 CCR1 (0.50) GAASMN1; SMN2KDM4ENPC1ALDH1A1
SCHEMBL25026536 0.78 CASP3 (0.39) SMN1; SMN2KDM4ENPC1RAB9ATSHR
SCHEMBL25028293 0.74 APP (0.61) GAASMN1; SMN2KDM4ENPC1ALDH1A1
SCHEMBL4531884 0.72 AGPAT2 (0.52) GAAMGAMSIMGAM2SMN1; SMN2
SCHEMBL29081219 0.72 KDM4E (0.66) GAAMGAMSIMGAM2SMN1; SMN2
SCHEMBL23954341 0.71 KDM4E (0.77) GAASMN1; SMN2KDM4ENPC1ALDH1A1
SCHEMBL16399910 0.70 KMT2A (0.38) SMN1; SMN2RAB9AHSD17B10HTTMEN1
SCHEMBL197456 0.70 CCR1 (0.46) TGFBR1LMNACASP3

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-20230050869-A1 THERMOELECTRIC CONVERSION MATERIAL, AND THERMOELECTRIC CONVERSION ELEMENT PREPARED THEREWITH TOYO INK SC HOLDINGS CO., LTD. (JP) 2023-02-16 US disclosed