SCHEMBL4368156

SCHEMBL4368156

O=C(O)c1cc(CO[N+](=O)[O-])ccc1-c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 5/20 0.58
LTB4R Q15722 1/20 0.46
LTB4R2 Q9NPC1 1/20 0.46
PTPN1 P18031 3/20 0.44
PTPN2 P17706 1/20 0.44
PTPN6 P29350 1/20 0.44
HSD17B10 Q99714 1/20 0.43
TMEM97 Q5BJF2 3/20 0.40
EIF4E P06730 1/20 0.40
MYC P01106 1/20 0.40
MAX P61244 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
RXRA P19793 1/20 0.39
RXRB P28702 1/20 0.39
RXRG P48443 1/20 0.39
PTGDR2 Q9Y5Y4 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
SCHEMBL28087917 0.89 PTPN1 (0.44) FOLH1PTPN1PTPN2PTPN6TMEM97
SCHEMBL22227471 0.84 LTB4R2 (0.49) LTB4R2
SCHEMBL6677061 0.77 FOLH1 (0.61) FOLH1LTB4RLTB4R2PTPN1PTPN2
SCHEMBL22227469 0.77 FOLH1 (0.45) FOLH1EIF4ESMN1; SMN2
SCHEMBL9407400 0.77 FOLH1 (0.75) FOLH1LTB4RLTB4R2PTPN1PTPN2
SCHEMBL3639419 0.77 HNF4A (0.45) FOLH1PTPN1PTPN2PTPN6HSD17B10
SCHEMBL2998914 0.76 HNF4A (0.52) PTPN1PTPN2PTPN6TMEM97
SCHEMBL2713834 0.76 HNF4A (0.52) PTPN1PTPN2PTPN6TMEM97
SCHEMBL28087997 0.76 HDAC7 (0.43) FOLH1LTB4RLTB4R2PTPN1PTPN2
SCHEMBL28088001 0.75 IDO1 (0.52) TMEM97

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-7622612-B2 Tricyclic derivatives and their use CHEMTECH RESEARCH INCORPORATION (KR) 2009-11-24 US claimed
US-20070021427-A1 Novel tricyclic derivatives and their use CHEMTECH RESEARCH INCORPORATION (KR) 2007-01-25 US claimed
US-7622612-B2 Tricyclic derivatives and their use CHEMTECH RESEARCH INCORPORATION (KR) 2009-11-24 US disclosed
US-20070021427-A1 Novel tricyclic derivatives and their use CHEMTECH RESEARCH INCORPORATION (KR) 2007-01-25 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-20070021427-A1 Novel tricyclic derivatives and their use NFATC1, IL2, CCL2 FOLH1 131/4885LTB4R 748/4885LTB4R2 597/4885

“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.