SCHEMBL6288350

SCHEMBL6288350

O=C1CC=C(Cl)c2cccnc21

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S100A4 P26447 7/20 0.49
CDC25B P30305 3/20 0.49
TDP2 O95551 3/20 0.47
NSD2 O96028 3/20 0.47
PAX8 Q06710 3/20 0.47
ABL1 P00519 1/20 0.47
PLCG1 P19174 1/20 0.47
CES1 P23141 1/20 0.47
RIN1 Q13671 1/20 0.47
MEN1 O00255 1/20 0.47
THRB P10828 1/20 0.47
BLM P54132 1/20 0.47
KMT2A Q03164 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
GAA P10253 1/20 0.47
PTPRC P08575 2/20 0.43
CTSL P07711 1/20 0.43
CTSS P25774 1/20 0.43
PTPN13 Q12923 1/20 0.43
PADI1 Q9ULC6 2/20 0.38

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
SCHEMBL27616642 0.77 TDP2 (0.46) S100A4CDC25BTDP2NSD2PAX8
SCHEMBL28754189 0.73 MAPT (0.44) S100A4CDC25BTDP2NSD2PAX8
SCHEMBL16047148 0.72 IDO1 (0.41) S100A4CDC25BTDP2PLCG1CES1
SCHEMBL29727870 0.72 IDO1 (0.41) S100A4CDC25BTDP2PLCG1CES1
SCHEMBL30665385 0.71 TDP2 (0.56) S100A4CDC25BTDP2NSD2PAX8
SCHEMBL2604368 0.71 TDP2 (0.56) S100A4CDC25BTDP2NSD2PAX8
SCHEMBL829095 0.68 TDP2 (0.52) S100A4CDC25BTDP2NSD2PAX8
SCHEMBL22990892 0.67 TDP2 (0.50) S100A4CDC25BTDP2NSD2PAX8
Hydrochloric Acid SCHEMBL11105978 0.67 TDP2 (0.50) S100A4CDC25BTDP2NSD2PAX8
SCHEMBL28057220 0.67 S100A4 (0.47) S100A4CDC25BTDP2NSD2PAX8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6951939-B2 Multivalent platform molecules comprising high molecular weight polyethylene oxide LA JOLLA PHARMACEUTICAL COMPANY (US) 2005-10-04 US claimed
US-20050175620-A1 Multivalent platform molecules comprising high molecular weight polyethylene oxide LA JOLLA PHARMACEUTICAL CO. 2005-08-11 US disclosed
EP-1292337-A2 MULTIVALENT PLATFORM MOLECULES COMPRISING HIGH MOLECULAR WEIGHT POLYETHYLENE OXIDE LA JOLLA PHARMACEUTICAL (US) 2003-03-19 EP disclosed
US-20020110535-A1 Multivalent platform molecules comprising high molecular weight polyethylene oxide LA JOLLA PHARMACEUTICAL COMPANY 2002-08-15 US disclosed
US-20020107389-A1 Conjugates of chemically defined non-polymeric valency platform molecules and biologically active molecules LA JOLLA PHARMACEUTICAL COMPANY 2002-08-08 US disclosed
US-20020082400-A1 Conjugates of T cell epitope deficient immunogen analogs for humoral anergy and chemically defined non-polymeric valency platform molecules LA JOLLA PHARMACEUTICAL COMPANY 2002-06-27 US disclosed
WO-2001093914-A2 MULTIVALENT PLATFORM MOLECULES COMPRISING HIGH MOLECULAR WEIGHT POLYETHYLENE OXIDE LA JOLLA PHARMACEUTICAL COMPANY (US) 2001-12-13 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050175620-A1 Multivalent platform molecules comprising high molecular weight polyethylene oxide TLR3, ACP1, TLR9 S100A4 2116/4885CDC25B 4024/4885TDP2 2586/4885
US-20020110535-A1 Multivalent platform molecules comprising high molecular weight polyethylene oxide TLR3, ACP1, TLR9 S100A4 2116/4885CDC25B 4024/4885TDP2 2586/4885
US-20020082400-A1 Conjugates of T cell epitope deficient immunogen analogs for humoral anergy and chemically defined non-polymeric valency platform molecules SSB, CD4, LY96 S100A4 2555/4885CDC25B 923/4885TDP2 316/4885
US-20020107389-A1 Conjugates of chemically defined non-polymeric valency platform molecules and biologically active molecules SSB, PCNA, NASP S100A4 1532/4885CDC25B 2797/4885TDP2 449/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.