SCHEMBL7488073

SCHEMBL7488073

CCN(CC)CCn1nc2c3c(c(N)ccc31)Sc1ccccc1-2

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TOP2A P11388 5/20 0.50
TOP2B Q02880 2/20 0.50
POLB P06746 5/20 0.47
KMT2A Q03164 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
NPC1 O15118 2/20 0.47
RAD52 P43351 2/20 0.47
RAB9A P51151 2/20 0.47
MITF O75030 1/20 0.47
DNMT1 P26358 1/20 0.47
HTT P42858 1/20 0.47
UHRF1 Q96T88 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
CYP1A2 P05177 2/20 0.35
MEN1 O00255 1/20 0.35
TNNI3 P19429 1/20 0.35
MAPK1 P28482 1/20 0.35
STAT6 P42226 1/20 0.35
TNNT2 P45379 1/20 0.35
TNNC1 P63316 1/20 0.35

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
Hydrochloric Acid SCHEMBL10925309 0.99 TOP2A (0.49) TOP2ATOP2BPOLBKMT2ASMN1; SMN2
SCHEMBL11127481 0.93 TOP2A (0.44) TOP2ATOP2BPOLBKMT2ASMN1; SMN2
SCHEMBL7495129 0.89 TOP2A (0.50) TOP2ATOP2BPOLBKMT2ASMN1; SMN2
SCHEMBL10925471 0.88 TOP2A (0.39) TOP2ATOP2BPOLBKMT2ASMN1; SMN2
SCHEMBL11748467 0.86 TOP2A (0.57) TOP2ATOP2BPOLBKMT2ASMN1; SMN2
SCHEMBL8486664 0.86 TOP2A (0.48) TOP2ATOP2BPOLBKMT2ASMN1; SMN2
SCHEMBL8488003 0.86 TOP2A (0.46) TOP2ATOP2BPOLBKMT2ASMN1; SMN2
SCHEMBL10812083 0.85 TOP2A (0.47) TOP2ATOP2BPOLBKMT2ASMN1; SMN2
SCHEMBL10477218 0.85 TOP2A (0.58) TOP2ATOP2BPOLBKMT2ASMN1; SMN2
SCHEMBL7494000 0.85 TOP2A (0.68) TOP2ATOP2BPOLBKMT2ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0114002-B1 BENZOTHIOPYRANO(4,3,2,-CD)INDAZOLES, THEIR PHARMACEUTICAL COMPOSITIONS AND METHODS FOR THEIR PRODUCTION WARNER-LAMBERT COMPANY (US) 1987-03-04 EP claimed
EP-0114002-A2 Benzothiopyrano(4,3,2,-cd)indazoles, their pharmaceutical compositions and methods for their production WARNER-LAMBERT COMPANY (US) 1984-07-25 EP claimed
EP-0812192-B1 BENZOTHIOPYRANOINDAZOLES ANTITUMOR AGENTS SANOFI SYNTHELABO (FR) 2002-11-06 EP disclosed
EP-0812192-A4 BENZOTHIOPYRANOINDAZOLES ANTITUMOR AGENTS SANOFI WINTHROP INC (US) 2000-03-08 EP disclosed
EP-0812192-A1 BENZOTHIOPYRANOINDAZOLES ANTITUMOR AGENTS SANOFI WINTHROP, INC. (US) 1997-12-17 EP disclosed
WO-1996026723-A1 BENZOTHIOPYRANOINDAZOLES ANTITUMOR AGENTS SANOFI WINTHROP, INC. (US) 1996-09-06 WO disclosed
US-5532263-A Benzothiopyranoindazole antitumor agents STERLING WINTHROP INC. (US) 1996-07-02 US disclosed
EP-0114002-B1 BENZOTHIOPYRANO(4,3,2,-CD)INDAZOLES, THEIR PHARMACEUTICAL COMPOSITIONS AND METHODS FOR THEIR PRODUCTION WARNER-LAMBERT COMPANY (US) 1987-03-04 EP disclosed
US-4604390-A FUNGICIDES, ANTITUMOR AGENTS WARNER-LAMBERT COMPANY (US) 1986-08-05 US disclosed
EP-0114002-A2 Benzothiopyrano(4,3,2,-cd)indazoles, their pharmaceutical compositions and methods for their production WARNER-LAMBERT COMPANY (US) 1984-07-25 EP disclosed