SCHEMBL6072244

SCHEMBL6072244

O=C(NCCOc1ccccc1)c1cc(Oc2ccc3c(c2)CCN3C(=O)O)ccn1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 4/20 0.43
LMNA P02545 3/20 0.42
UCHL1 P09936 1/20 0.42
NPC1 O15118 4/20 0.41
RAB9A P51151 4/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
HPGD P15428 1/20 0.41
POLB P06746 2/20 0.41
TP53 P04637 1/20 0.41
RECQL P46063 1/20 0.41
MET P08581 1/20 0.40
MAPT P10636 1/20 0.40
NFKB1 P19838 1/20 0.40
NR2C2 P49116 1/20 0.40
NFKB2 Q00653 1/20 0.40
RELA Q04206 1/20 0.40
TAB1 Q15750 1/20 0.40

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
SCHEMBL6072190 0.91 HTT (0.46) LMNASMN1; SMN2HPGDPOLBTP53
SCHEMBL6072351 0.89 SMN1; SMN2 (0.47) RIPK1LMNASMN1; SMN2POLBTP53
SCHEMBL6072145 0.88 MET (0.47) RIPK1LMNAPOLBTP53MET
SCHEMBL6071686 0.86 LMNA (0.48) RIPK1LMNANPC1RAB9ASMN1; SMN2
SCHEMBL6072240 0.86 ALDH1A1 (0.49) LMNASMN1; SMN2HPGDPOLBTP53
SCHEMBL6072249 0.85 HRH3 (0.48) RIPK1LMNAPOLBTP53MET
SCHEMBL6071666 0.84 BRAF (0.53)
SCHEMBL6072492 0.84 ADRB2 (0.47) RIPK1POLBTP53MET
SCHEMBL6072163 0.84 KDR (0.47) RIPK1NPC1RAB9ASMN1; SMN2TP53
SCHEMBL6072975 0.83 RAF1 (0.54) LMNAPOLBTP53MET

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060241149-A1 Chemical compounds ADAMS JERRY L 2006-10-26 US disclosed
US-20060106048-A1 Furoisoquinoline derivative and use thereof PASCALI, PETROS P. (CY) 2006-05-18 US disclosed
EP-1541576-A1 FUROISOQUINOLINE DERIVATIVE AND USE THEREOF Takeda Pharmaceutical Company Limited (JP) 2005-06-15 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 (2 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-20060241149-A1 Chemical compounds CHKB, MAP3K20, MAP3K6 RIPK1 627/4885LMNA 2570/4885UCHL1 901/4885
US-20060106048-A1 Furoisoquinoline derivative and use thereof PDE3B, PDE2A, PDE3A RIPK1 3251/4885LMNA 2455/4885UCHL1 1249/4885

“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.