SCHEMBL8625569

SCHEMBL8625569

O=[N+]([O-])c1ccc(S(=O)(=O)Nc2cccnc2Nc2ccccc2)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.63
SMN1; SMN2 Q16637 2/20 0.63
NFKBIA P25963 2/20 0.61
RELA Q04206 1/20 0.61
CA12 O43570 1/20 0.60
CA2 P00918 1/20 0.60
CA9 Q16790 1/20 0.60
TUBB4A P04350 1/20 0.55
TUBB P07437 1/20 0.55
TUBA3C P0DPH7 1/20 0.55
TUBA1B P68363 1/20 0.55
TUBA4A P68366 1/20 0.55
TUBB4B P68371 1/20 0.55
TUBB3 Q13509 1/20 0.55
TUBB2A Q13885 1/20 0.55
TUBB8 Q3ZCM7 1/20 0.55
TUBA3E Q6PEY2 1/20 0.55
TUBA1A Q71U36 1/20 0.55
TUBA1C Q9BQE3 1/20 0.55
TUBB6 Q9BUF5 1/20 0.55

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
SCHEMBL7006004 0.87 TUBB4A (0.60) NFKBIATUBB4ATUBBTUBA3CTUBA1B
SCHEMBL8623534 0.85 KMT2A (0.60) SMN1; SMN2NFKBIACA12CA2CA9
SCHEMBL8623823 0.84 TUBB4A (0.61) SMN1; SMN2CA12CA2CA9TUBB4A
SCHEMBL8623512 0.84 TUBB4A (0.74) MAPK1NFKBIATUBB4ATUBBTUBA3C
SCHEMBL8623477 0.84 SLC40A1 (0.59) SMN1; SMN2NFKBIATUBB4ATUBBTUBA3C
SCHEMBL8626115 0.81 TUBB4A (0.65) MAPK1SMN1; SMN2NFKBIATUBB4ATUBB
SCHEMBL8625500 0.81 TUBB4A (0.57) NFKBIATUBB4ATUBBTUBA3CTUBA1B
SCHEMBL8623536 0.81 TUBB4A (0.81) MAPK1SMN1; SMN2TUBB4ATUBBTUBA3C
SCHEMBL8628608 0.81 GLO1 (0.61) NFKBIATUBB4ATUBBTUBA3CTUBA1B
SCHEMBL8625690 0.80 CA12 (0.61) CA12CA9TUBB4ATUBBTUBA3C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0472053-B1 Sulfonamide derivatives EISAI CO LTD (JP) 1998-06-17 EP disclosed
US-5610304-A Pyrimidinyl or pyridinyl sulfonamide substituted compounds EISAI CO., LTD. (JP) 1997-03-11 US disclosed
US-5610320-A ANTITUMOR AGENTS EISAI CO., LTD. (JP) 1997-03-11 US disclosed
US-5434172-A Antitumor EISAI CO., LTD. (JP) 1995-07-18 US disclosed
US-5332751-A Antitumor EISAI CO., LTD. (JP) 1994-07-26 US disclosed
US-5292758-A Sulfonamide derivatives EISAI CO., LTD. (JP) 1994-03-08 US disclosed
US-5250549-A Antitumor agents EISAI CO., LTD. (JP) 1993-10-05 US disclosed
EP-0472053-A2 Sulfonamide derivatives Eisai Co., Ltd. (JP) 1992-02-26 EP disclosed