SCHEMBL7573476

SCHEMBL7573476

CCc1ccc(Nc2c(C(=O)O)cccc2C(=O)O)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CLCN2 P51788 1/20 0.50
RAB9A P51151 6/20 0.48
ALDH1A1 P00352 5/20 0.48
NPC1 O15118 4/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
XDH P47989 1/20 0.46
SLC22A12 Q96S37 1/20 0.46
MAPT P10636 3/20 0.46
KMT2A Q03164 5/20 0.44
CXCR2 P25025 1/20 0.43
CRHBP P24387 1/20 0.43
CRHR2 Q13324 1/20 0.43
TP53 P04637 1/20 0.43
SRC P12931 1/20 0.42
MEN1 O00255 4/20 0.42
USP2 O75604 2/20 0.42
HPGD P15428 1/20 0.42
TSHR P16473 1/20 0.42
RECQL P46063 1/20 0.42
BLM P54132 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
SCHEMBL16862346 0.85 KMT2A (0.56) RAB9AALDH1A1SMN1; SMN2MAPTKMT2A
SCHEMBL10144156 0.82 FABP4 (0.65) CLCN2RAB9AALDH1A1NPC1SMN1; SMN2
SCHEMBL8285642 0.80 CXCR2 (0.60) CLCN2ALDH1A1SMN1; SMN2MAPTKMT2A
SCHEMBL28276373 0.78 POLB (0.48) ALDH1A1KMT2ACXCR2MEN1HPGD
SCHEMBL2445505 0.77 CXCR2 (0.46) CLCN2RAB9AALDH1A1SMN1; SMN2MAPT
SCHEMBL7566561 0.77 RAB9A (0.62) RAB9AALDH1A1NPC1SMN1; SMN2MAPT
SCHEMBL7568727 0.77 AKR1C3 (0.54) XDHSLC22A12MAPTKMT2ACXCR2
SCHEMBL7829395 0.75 ALDH1A1 (0.70) RAB9AALDH1A1NPC1SMN1; SMN2MAPT
SCHEMBL6476627 0.75 MEN1 (0.63) CLCN2RAB9AALDH1A1NPC1MAPT
Phthalic Acid SCHEMBL28190444 0.74 ALDH1A1 (0.64) CLCN2ALDH1A1SMN1; SMN2KMT2ATP53

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
EP-0934278-B1 BIS(ACRIDINECARBOXAMIDE) AND BIS(PHENAZINECARBOXAMIDE) AS ANTITUMOUR AGENTS XENOVA LTD (GB) 2002-09-04 EP disclosed
US-6114332-A BACTERICIDES XENOVA LIMITED (GB) 2000-09-05 US disclosed
EP-0934278-A1 BIS(ACRIDINECARBOXAMIDE) AND BIS(PHENAZINECARBOXAMIDE) AS ANTITUMOUR AGENTS XENOVA LIMITED (GB) 1999-08-11 EP disclosed
WO-1998017650-A1 BIS(ACRIDINECARBOXAMIDE) AND BIS(PHENAZINECARBOXAMIDE) AS ANTITUMOUR AGENTS XENOVA LIMITED (GB) 1998-04-30 WO disclosed