SCHEMBL2955201

SCHEMBL2955201

N#Cc1cnccc1OCC(=O)Nc1ccc(Cl)cn1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.59
NPC1 O15118 5/20 0.59
TSHR P16473 3/20 0.59
TP53 P04637 3/20 0.59
MAPT P10636 3/20 0.59
SMN1; SMN2 Q16637 2/20 0.59
MAPK1 P28482 2/20 0.59
LMNA P02545 2/20 0.59
PKM P14618 2/20 0.59
HPGD P15428 2/20 0.59
NFKB1 P19838 1/20 0.59
NFKB2 Q00653 1/20 0.59
RELA Q04206 1/20 0.59
NOTUM Q6P988 1/20 0.52
NPSR1 Q6W5P4 1/20 0.51
PORCN Q9H237 1/20 0.48
ALDH1A1 P00352 2/20 0.48
TDP1 Q9NUW8 1/20 0.48
L3MBTL1 Q9Y468 2/20 0.47
KMT2A Q03164 2/20 0.47

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
SCHEMBL2945042 0.91 RAB9A (0.59) RAB9ANPC1TSHRTP53MAPT
SCHEMBL13515803 0.86 RAB9A (0.72) RAB9ANPC1TSHRTP53MAPT
SCHEMBL2942298 0.86 RAB9A (0.72) RAB9ANPC1TSHRTP53MAPT
SCHEMBL2948912 0.83 RAB9A (0.64) RAB9ANPC1TSHRTP53MAPT
SCHEMBL2942258 0.83 RAB9A (0.64) RAB9ANPC1TSHRTP53MAPT
SCHEMBL13665142 0.82 RAB9A (0.63) RAB9ANPC1TSHRTP53MAPT
SCHEMBL13515760 0.82 TSHR (0.66) RAB9ANPC1TSHRTP53MAPT
SCHEMBL2953398 0.82 RAB9A (0.59) RAB9ANPC1TSHRTP53MAPT
SCHEMBL4200025 0.81 RAB9A (0.61) RAB9ANPC1TSHRTP53MAPT
SCHEMBL2943934 0.81 RAB9A (0.60) RAB9ANPC1TSHRTP53MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7737161-B2 Condensed furan compounds MITSUBISHI TANABE PHARMA CORPORATION (JP) 2010-06-15 US disclosed
US-7737161-B2 Condensed furan compounds MITSUBISHI TANABE PHARMA CORPORATION (JP) 2010-06-15 US disclosed
US-7737161-B2 Condensed furan compounds MITSUBISHI TANABE PHARMA CORPORATION (JP) 2010-06-15 US disclosed
US-20090156803-A1 Condensed furan compounds KAWAGUCHI TAKAYUKI 2009-06-18 US disclosed
US-20090156803-A1 Condensed furan compounds KAWAGUCHI TAKAYUKI 2009-06-18 US disclosed
US-20090156803-A1 Condensed furan compounds KAWAGUCHI TAKAYUKI 2009-06-18 US disclosed
US-7514449-B2 Fused furan compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-04-07 US disclosed
US-7514449-B2 Fused furan compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-04-07 US disclosed
US-7514449-B2 Fused furan compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-04-07 US disclosed
US-20060094724-A1 Fused furan compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2006-05-04 US disclosed
EP-1582521-A1 FUSED FURAN COMPOUND TANABE SEIYAKU CO., LTD. (JP) 2005-10-05 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-20090156803-A1 Condensed furan compounds F2, F12, F11 RAB9A 4692/4885NPC1 4426/4885TSHR 3368/4885
US-20060094724-A1 Fused furan compound F2, F12, F11 RAB9A 4494/4885NPC1 4566/4885TSHR 3045/4885

“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.