SCHEMBL28065441

SCHEMBL28065441

CC(=O)Nc1sc(C)c(-c2cccs2)c1C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 9/20 0.47
▸ POLB P06746 4/20 0.47
▸ TP53 P04637 2/20 0.47
▸ GAA P10253 2/20 0.47
▸ GFER P55789 1/20 0.47
▸ KDM4E B2RXH2 5/20 0.46
▸ SMN1; SMN2 Q16637 4/20 0.46
▸ ALDH1A1 P00352 6/20 0.44
▸ HPGD P15428 5/20 0.44
▸ MAPK1 P28482 2/20 0.43
▸ HSD17B10 Q99714 2/20 0.43
▸ NPC1 O15118 2/20 0.43
▸ LMNA P02545 3/20 0.42
▸ TDP1 Q9NUW8 3/20 0.42
▸ NPSR1 Q6W5P4 2/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ RAB9A P51151 2/20 0.42
▸ USP2 O75604 1/20 0.42
▸ MAPK10 P53779 1/20 0.42

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
SCHEMBL13837823 0.80 ALDH1A1 (0.58) MAPTPOLBGAAKDM4ESMN1; SMN2
SCHEMBL418864 0.74 SERPINE1 (0.48) MAPTPOLBTP53GAAGFER
SCHEMBL3193754 0.71 MAPT (0.48) MAPTPOLBTP53GAAGFER
SCHEMBL21612947 0.71 ALDH1A1 (0.61) MAPTPOLBTP53GAAALDH1A1
SCHEMBL5430188 0.70 ALDH1A1 (0.55) MAPTPOLBTP53GAAKDM4E
SCHEMBL6316142 0.69 KDM4E (0.47) MAPTPOLBTP53GAAGFER
SCHEMBL1800640 0.68 ALDH1A1 (0.72) MAPTGAAKDM4ESMN1; SMN2ALDH1A1
Cyclohexane SCHEMBL7825607 0.67 ABCC1 (0.57) MAPTPOLBTP53SMN1; SMN2ALDH1A1
SCHEMBL5851124 0.67 ALDH1A1 (0.78) MAPTPOLBGAASMN1; SMN2ALDH1A1
SCHEMBL27490522 0.67 KDM4E (0.52) MAPTGAAKDM4EALDH1A1LMNA

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
CN-104013616-B Amide groups-thiophenes is in the application of preparing in anti-HIV-1 virus drugs Guangzhou Zhongheng Electronic Technology Co.,Ltd. (CN) 2016-05-18 — — CN disclosed
CN-104013616-B Amide groups-thiophenes is in the application of preparing in anti-HIV-1 virus drugs Guangzhou Zhongheng Electronic Technology Co.,Ltd. (CN) 2016-05-18 — — CN disclosed
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