SCHEMBL2398284

SCHEMBL2398284

O=C(Nc1ccc(C(=O)O)s1)c1cc2c3c(c1)CCCC3CCC2

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RNASEH1 O60930 1/20 0.41
AR P10275 5/20 0.41
NR3C1 P04150 4/20 0.41
SMN1; SMN2 Q16637 4/20 0.38
RAB9A P51151 3/20 0.38
TP53 P04637 3/20 0.38
NFKB1 P19838 3/20 0.38
NFKB2 Q00653 3/20 0.38
RELA Q04206 3/20 0.38
NPC1 O15118 2/20 0.38
MAPT P10636 2/20 0.38
ALDH1A1 P00352 2/20 0.38
DAO P14920 1/20 0.38
HTT P42858 2/20 0.37
GAA P10253 2/20 0.36
TAS1R3 Q7RTX0 1/20 0.35
TAS1R1 Q7RTX1 1/20 0.35
SERPINE1 P05121 1/20 0.34
ALOX15 P16050 1/20 0.34
HSD17B10 Q99714 1/20 0.34

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
SCHEMBL2396145 0.90 AR (0.42) RNASEH1ARNR3C1SMN1; SMN2RAB9A
SCHEMBL2394784 0.80 NPC1 (0.47) SMN1; SMN2RAB9ATP53NFKB1NFKB2
SCHEMBL2396267 0.79 RNASEH1 (0.38) RNASEH1ARNR3C1SMN1; SMN2RAB9A
SCHEMBL2394763 0.77 MEN1 (0.54) SMN1; SMN2RAB9ATP53NFKB1NFKB2
SCHEMBL28482288 0.74 RNASEH1 (0.68) RNASEH1SMN1; SMN2RAB9ATP53NFKB1
SCHEMBL828937 0.73 ALDH1A1 (0.48) MAPTALDH1A1HTTTAS1R3TAS1R1
SCHEMBL2393053 0.73 MEN1 (0.52) SMN1; SMN2RAB9ATP53NFKB1NFKB2
SCHEMBL2394947 0.73 RAB9A (0.52) SMN1; SMN2RAB9ATP53NFKB1NFKB2
SCHEMBL2397116 0.72 HCAR3 (0.58) RAB9ANPC1
SCHEMBL2397423 0.72 KMT2A (0.60) SMN1; SMN2RAB9ATP53NFKB1NFKB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2189443-B1 TRICYCLIC AMIDE COMPOUND RES FOUND ITSUU LAB (JP) 2013-10-23 EP disclosed
US-8232300-B2 Tricyclic amide compound RESEARCH FOUNDATION ITSUU LABORATORY (JP) 2012-07-31 US disclosed
US-8232300-B2 Tricyclic amide compound RESEARCH FOUNDATION ITSUU LABORATORY (JP) 2012-07-31 US disclosed
US-8232300-B2 Tricyclic amide compound RESEARCH FOUNDATION ITSUU LABORATORY (JP) 2012-07-31 US disclosed
US-20110213157-A1 TRICYCLIC AMIDE COMPOUND RESEARCH FOUNDATION ITSUU LABORATORY (JP) 2011-09-01 US disclosed
US-20110213157-A1 TRICYCLIC AMIDE COMPOUND RESEARCH FOUNDATION ITSUU LABORATORY (JP) 2011-09-01 US disclosed
US-20110213157-A1 TRICYCLIC AMIDE COMPOUND RESEARCH FOUNDATION ITSUU LABORATORY (JP) 2011-09-01 US disclosed
EP-2189443-A1 TRICYCLIC AMIDE COMPOUND Research Foundation Itsuu Laboratory (JP) 2010-05-26 EP 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-20110213157-A1 TRICYCLIC AMIDE COMPOUND RXRA, RXRB, RXRG RNASEH1 938/4885AR 74/4885NR3C1 191/4885

“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.