SCHEMBL22304466

SCHEMBL22304466

Cc1ccc(Sc2cc(C(C)(C)C)ccc2SC(C)(C)C)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 1/20 0.44
▸ MAPT P10636 5/20 0.40
▸ LMNA P02545 4/20 0.40
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ NPSR1 Q6W5P4 2/20 0.40
▸ ALOX12 P18054 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ ALDH1A1 P00352 5/20 0.40
▸ MLYCD O95822 1/20 0.39
▸ TDP1 Q9NUW8 2/20 0.39
▸ GAA P10253 2/20 0.36
▸ PTGES O14684 1/20 0.36
▸ HTR1A P08908 2/20 0.35
▸ HTR3A P46098 2/20 0.35
▸ L3MBTL1 Q9Y468 4/20 0.35
▸ MAPK1 P28482 3/20 0.35
▸ HPGD P15428 2/20 0.35
▸ ALOX15 P16050 2/20 0.35
▸ HSD17B10 Q99714 2/20 0.35

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
SCHEMBL23598230 0.85 MAPT (0.40) MAPTMEN1KMT2ANPSR1HTT
SCHEMBL14176617 0.81 TSHR (0.48) TSHRMAPTLMNAMEN1KMT2A
SCHEMBL13216635 0.79 MAPT (0.61) MAPTLMNAMEN1KMT2ANPSR1
SCHEMBL31345546 0.76 MAPT (0.54) TSHRMAPTLMNAKMT2AHTT
SCHEMBL22304468 0.75 TSHR (0.41) TSHRMAPTLMNAMEN1KMT2A
SCHEMBL12733318 0.74 TSHR (0.71) TSHRMAPTLMNAMEN1KMT2A
SCHEMBL20022733 0.69 HTR1A (0.39) TSHRMAPTLMNAMEN1KMT2A
SCHEMBL5114168 0.69 ALDH1A1 (0.41) MAPTLMNAMEN1KMT2ANPSR1
SCHEMBL26857854 0.68 ALDH1A1 (0.57) TSHRMAPTLMNAMEN1KMT2A
SCHEMBL14773861 0.68 TSHR (0.43) TSHRMAPTLMNAMEN1KMT2A

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-11241818-B2 Pipe-shaped integrally molded article and production method for pipe-shaped integrally molded article TORAY INDUSTRIES, INC. (JP) 2022-02-08 — — US disclosed
US-20200247028-A1 PIPE-SHAPED INTEGRALLY MOLDED ARTICLE AND PRODUCTION METHOD FOR PIPE-SHAPED INTEGRALLY MOLDED ARTICLE TORAY INDUSTRIES, INC. (JP) 2020-08-06 — — US disclosed
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