SCHEMBL3390263

SCHEMBL3390263

CN(C(=O)O)c1nc2ccc(C(=O)c3cccs3)cc2[nH]1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.59
ABL1 P00519 3/20 0.59
MAPT P10636 3/20 0.59
CYP2C9 P11712 3/20 0.59
LMNA P02545 2/20 0.59
TUBB4A P04350 2/20 0.59
TUBB P07437 2/20 0.59
TUBA3C P0DPH7 2/20 0.59
TUBA1B P68363 2/20 0.59
TUBA4A P68366 2/20 0.59
TUBB4B P68371 2/20 0.59
TUBB3 Q13509 2/20 0.59
TUBB2A Q13885 2/20 0.59
TUBB8 Q3ZCM7 2/20 0.59
TUBA3E Q6PEY2 2/20 0.59
TUBA1A Q71U36 2/20 0.59
TUBA1C Q9BQE3 2/20 0.59
TUBB6 Q9BUF5 2/20 0.59
TUBB2B Q9BVA1 2/20 0.59
TUBB1 Q9H4B7 2/20 0.59

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
SCHEMBL774946 0.91 NPC1 (0.48) ALDH1A1ABL1MAPTCYP2C9LMNA
SCHEMBL3388847 0.83 ALDH1A1 (0.65) ALDH1A1ABL1CYP2C9LMNACYP1A2
SCHEMBL11294519 0.78 ABL1 (0.65) ALDH1A1ABL1MAPTCYP2C9LMNA
SCHEMBL1467119 0.78 MEN1 (0.45) ALDH1A1ABL1MAPTCYP2C9LMNA
SCHEMBL4557188 0.77 ABL1 (0.78) ALDH1A1ABL1MAPTCYP2C9LMNA
Nocodazole SCHEMBL2324427 0.74 ABL1 (1.00) ALDH1A1ABL1MAPTCYP2C9LMNA
Nocodazole SCHEMBL29573963 0.74 ABL1 (1.00) ALDH1A1ABL1MAPTCYP2C9LMNA
SCHEMBL5679984 0.74 CHEK2 (0.81) ALDH1A1ABL1MAPTCYP2C9LMNA
SCHEMBL11258670 0.74 ABL1 (0.69) ALDH1A1ABL1MAPTCYP2C9LMNA
SCHEMBL11436852 0.73 PIN1 (0.59) ALDH1A1LMNATUBB4ATUBBTUBA3C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107980620-B Composition for chromosome doubling of corn haploid seedlings 沈阳农业大学 2021-03-16 CN disclosed
US-20100108287-A1 STRUCTURE FOR COOLING OHSHIN MLP CO., LTD. (JP) 2010-05-06 US disclosed
EP-0952248-B1 A molded antimicrobial article and a process for its production TORAY INDUSTRIES (JP) 2006-05-31 EP disclosed
US-20020018794-A1 Clothing TORAY INDUSTRIES, INC., A CORPORATION OF JAPAN (JP) 2002-02-14 US disclosed
US-6344207-B1 CLOTHING TORAY INDUSTRIES, INC. (JP) 2002-02-05 US disclosed