SCHEMBL2869560

SCHEMBL2869560

COc1ccnc(Nc2cccc(-c3cnc(N4CCOCC4)s3)n2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 2/20 0.46
CYP3A4 P08684 1/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C9 P11712 1/20 0.45
MAPT P10636 1/20 0.44
MTOR P42345 1/20 0.42
SMG1 Q96Q15 1/20 0.42
CHEK1 O14757 3/20 0.42
SYK P43405 4/20 0.41
POLB P06746 1/20 0.41
TGFBR1 P36897 3/20 0.41
FGFR1 P11362 2/20 0.39
EPHB4 P54760 2/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
ABL1 P00519 1/20 0.39
PDE7A Q13946 1/20 0.39
PDE3A Q14432 1/20 0.39
PDE10A Q9Y233 1/20 0.39

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
SCHEMBL2860446 0.87 KARS1 (0.49) KDRMAPTSMG1CHEK1SYK
SCHEMBL2862794 0.85 SYK (0.44) KDRCHEK1SYK
SCHEMBL13136404 0.84 SYK (0.43) KDRMAPTSYKALDH1A1LMNA
SCHEMBL2865747 0.84 SYK (0.44) KDRSYK
SCHEMBL2865750 0.84 SYK (0.44) KDRSYK
SCHEMBL2866684 0.83 RAB9A (0.47) KDRSYKKDM4E
SCHEMBL2868246 0.83 SYK (0.45) KDRMAPTSYKKDM4E
SCHEMBL2862487 0.82 SYK (0.47) KDRSYK
Hydrochloric Acid SCHEMBL2870194 0.81 SYK (0.46) KDRSYK
SCHEMBL2858943 0.77 SYK (0.45) KDRSYK

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
US-7803801-B2 Aminopyridine compounds having Syk inhibitory activity JAPAN TOBACCO, INC. (JP) 2010-09-28 US claimed
CN-101166734-A Novel aminopyridine compounds having Syk inhibitory activity JAPAN TOBACCO INC (JP) 2008-04-23 CN claimed
EP-1854793-A1 NOVEL AMINOPYRIDINE COMPOUND WITH Syk INHIBITORY ACTIVITY Japan Tobacco, Inc. (JP) 2007-11-14 EP claimed
US-20060205731-A1 Novel aminopyridine compounds having Syk inhibitory activity JAPAN TOBACCO INC. (JP) 2006-09-14 US claimed
US-7803801-B2 Aminopyridine compounds having Syk inhibitory activity JAPAN TOBACCO, INC. (JP) 2010-09-28 US disclosed
US-7803801-B2 Aminopyridine compounds having Syk inhibitory activity JAPAN TOBACCO, INC. (JP) 2010-09-28 US disclosed
US-7803801-B2 Aminopyridine compounds having Syk inhibitory activity JAPAN TOBACCO, INC. (JP) 2010-09-28 US disclosed
CN-101166734-A Novel aminopyridine compounds having Syk inhibitory activity JAPAN TOBACCO INC (JP) 2008-04-23 CN disclosed
EP-1854793-A1 NOVEL AMINOPYRIDINE COMPOUND WITH Syk INHIBITORY ACTIVITY Japan Tobacco, Inc. (JP) 2007-11-14 EP disclosed
US-20060205731-A1 Novel aminopyridine compounds having Syk inhibitory activity JAPAN TOBACCO INC. (JP) 2006-09-14 US 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 (1 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-20060205731-A1 Novel aminopyridine compounds having Syk inhibitory activity SYK, BTK, ZAP70 KDR 1094/4885CYP3A4 3836/4885CYP2D6 3305/4885

“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.