SCHEMBL11365205

SCHEMBL11365205

C=CC(Sc1ccccc1N)c1c(C(=O)O)ccc(C(=O)O)c1C(C=C)Sc1ccccc1N

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 4/20 0.38
▸ MAP2K1 Q02750 1/20 0.38
▸ KDM4E B2RXH2 6/20 0.37
▸ TDP1 Q9NUW8 3/20 0.37
▸ ALDH1A1 P00352 3/20 0.37
▸ MAPT P10636 6/20 0.36
▸ NPSR1 Q6W5P4 4/20 0.36
▸ MAPK1 P28482 3/20 0.36
▸ APOBEC3G Q9HC16 2/20 0.36
▸ MMP2 P08253 1/20 0.36
▸ KMT2A Q03164 5/20 0.35
▸ IDO1 P14902 1/20 0.35
▸ LMNA P02545 2/20 0.34
▸ MEN1 O00255 4/20 0.34
▸ CA12 O43570 1/20 0.34
▸ CA1 P00915 1/20 0.34
▸ CA2 P00918 1/20 0.34
▸ CA4 P22748 1/20 0.34
▸ CA7 P43166 1/20 0.34
▸ CA9 Q16790 1/20 0.34

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
SCHEMBL11352637 0.79 MAPT (0.49) POLBKDM4EALDH1A1MAPTNPSR1
SCHEMBL11357956 0.79 MAPT (0.49) POLBKDM4EALDH1A1MAPTNPSR1
SCHEMBL11293928 0.78 KDM4E (0.43) POLBMAP2K1KDM4ETDP1ALDH1A1
SCHEMBL11301378 0.74 POLB (0.48) POLBMAP2K1KDM4ETDP1ALDH1A1
SCHEMBL8745190 0.70 ALDH1A1 (0.43) POLBMAP2K1KDM4ETDP1ALDH1A1
SCHEMBL11298505 0.70 HSD17B10 (0.42) POLBKDM4ETDP1ALDH1A1MAPT
SCHEMBL11301366 0.69 POLB (0.41) POLBMAP2K1KDM4ETDP1ALDH1A1
SCHEMBL9357896 0.68 KMT2A (0.46) POLBMAP2K1KDM4ETDP1ALDH1A1
SCHEMBL1812157 0.67 MCL1 (0.49) POLBKDM4ETDP1ALDH1A1MAPT
SCHEMBL9753187 0.66 MAPT (0.45) POLBMAP2K1KDM4ETDP1ALDH1A1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4342859-A Bis(aminophenylthioalkyl)terephthalate and hardener for polyurethane elastomer thereof IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 1982-08-03 — — US claimed
US-4342859-A Bis(aminophenylthioalkyl)terephthalate and hardener for polyurethane elastomer thereof IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 1982-08-03 — — US disclosed
US-4342859-A Bis(aminophenylthioalkyl)terephthalate and hardener for polyurethane elastomer thereof IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 1982-08-03 — — US disclosed
US-4342859-A Bis(aminophenylthioalkyl)terephthalate and hardener for polyurethane elastomer thereof IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 1982-08-03 — — US disclosed
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