SCHEMBL5633263

SCHEMBL5633263

O=S(=O)(Nc1ccccc1OCC1CCN(c2ccncc2)CC1)c1ccc2ccccc2c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F10 P00742 2/20 0.55
MEN1 O00255 5/20 0.50
KMT2A Q03164 5/20 0.50
ALDH1A1 P00352 1/20 0.46
MAPT P10636 1/20 0.46
TDP1 Q9NUW8 2/20 0.46
GLO1 Q04760 1/20 0.46
TPSAB1 Q15661 3/20 0.46
F2 P00734 1/20 0.45
RAD52 P43351 1/20 0.44
GHSR Q92847 1/20 0.43
IKBKB O14920 1/20 0.42
CHUK O15111 1/20 0.42
POLB P06746 2/20 0.42
AGTR1 P30556 1/20 0.42
OGT O15294 1/20 0.42
HTR7 P34969 2/20 0.42
HTR1A P08908 1/20 0.42
HTR2A P28223 1/20 0.42
HTR2C P28335 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
SCHEMBL7112202 0.93 F10 (0.48) F10MEN1KMT2AALDH1A1MAPT
SCHEMBL5631650 0.87 ALDH1A1 (0.56) F10MEN1KMT2AALDH1A1MAPT
SCHEMBL6578432 0.78 F10 (0.46) F10MEN1KMT2AALDH1A1MAPT
SCHEMBL6577690 0.76 MEN1 (0.52) F10MEN1KMT2AALDH1A1MAPT
SCHEMBL5632729 0.76 F2 (0.55) F10MEN1KMT2AALDH1A1MAPT
SCHEMBL5633771 0.76 KMT2A (0.59) F10MEN1KMT2AALDH1A1MAPT
SCHEMBL5632390 0.74 ALDH1A1 (0.45) F10MEN1KMT2AALDH1A1MAPT
SCHEMBL9760077 0.74 F10 (0.49) F10KMT2AALDH1A1F2POLB
SCHEMBL8120701 0.72 TPSAB1 (0.74) F10MEN1KMT2AALDH1A1TPSAB1
SCHEMBL5634334 0.70 F10 (0.47) F10IKBKBCHUK

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-7173025-B1 Aminoheterocyclic derivatives as antithrombotic or anticoagulant agents ZENECA LIMITED (GB) 2007-02-06 US claimed
EP-0880502-B1 AMINOHETEROCYCLIC DERIVATIVES AS ANTITHROMBOTIC OR ANTICOAGULANT AGENTS ASTRAZENECA AB (SE) 2004-09-01 EP claimed
US-7173025-B1 Aminoheterocyclic derivatives as antithrombotic or anticoagulant agents ZENECA LIMITED (GB) 2007-02-06 US disclosed
EP-0880502-B1 AMINOHETEROCYCLIC DERIVATIVES AS ANTITHROMBOTIC OR ANTICOAGULANT AGENTS ASTRAZENECA AB (SE) 2004-09-01 EP disclosed