SCHEMBL12374668

SCHEMBL12374668

C=Cc1cccc(OCCSC)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 3/20 0.42
▸ TP53 P04637 1/20 0.42
▸ TLR4 O00206 1/20 0.40
▸ TLR2 O60603 1/20 0.40
▸ CHRNA7 P36544 2/20 0.40
▸ CHRNB2 P17787 1/20 0.40
▸ CHRNB4 P30926 1/20 0.40
▸ CHRNA3 P32297 1/20 0.40
▸ CHRNA4 P43681 1/20 0.40
▸ FURIN P09958 1/20 0.39
▸ NPC1 O15118 8/20 0.39
▸ SMN1; SMN2 Q16637 5/20 0.39
▸ HTT P42858 2/20 0.39
▸ LMNA P02545 2/20 0.39
▸ MAPT P10636 2/20 0.39
▸ MAPK1 P28482 2/20 0.39
▸ HPGD P15428 1/20 0.39
▸ RAB9A P51151 8/20 0.37
▸ POLB P06746 5/20 0.37
▸ L3MBTL1 Q9Y468 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
SCHEMBL26543052 0.92 TLR4 (0.43) TDP1TP53TLR4TLR2CHRNA7
SCHEMBL2282040 0.84 MAOA (0.54) TDP1TLR4TLR2FURINNPC1
SCHEMBL412110 0.81 KMT2A (0.50) TDP1TP53TLR4TLR2CHRNA7
SCHEMBL412094 0.80 TLR4 (0.60) TDP1TP53TLR4TLR2CHRNA7
SCHEMBL30023543 0.80 NPC1 (0.45) TDP1TP53TLR4TLR2CHRNA7
SCHEMBL1985566 0.80 NPC1 (0.45) TDP1TP53TLR4TLR2CHRNA7
SCHEMBL7992660 0.80 FURIN (0.43) TDP1TP53TLR4TLR2CHRNA7
SCHEMBL10071523 0.79 FURIN (0.50) TDP1TP53TLR4TLR2CHRNA7
SCHEMBL2623207 0.79 TSHR (0.57) TLR4TLR2KMT2A
SCHEMBL10071513 0.79 MAPK1 (0.49) TDP1TP53TLR4TLR2CHRNA7

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
EP-4047417-B1 CHEMICALLY AMPLIFIED NEGATIVE RESIST COMPOSITION AND RESIST PATTERN FORMING PROCESS SHINETSU CHEMICAL CO (JP) 2023-08-16 — — EP disclosed
US-7989478-B2 decreases expression of a Type I collage gene in a tissue to induce a reduction in accumulation of collagen and thereby improves tissue fibrosis SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-08-02 — — US disclosed
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