SCHEMBL4688034

SCHEMBL4688034

[CH2]Cc1ccccc1NC(C(=O)O)C(=O)CC1CCCCC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 2/20 0.43
EPHX2 P34913 2/20 0.43
NPC1 O15118 3/20 0.41
RAB9A P51151 3/20 0.41
PPM1D O15297 1/20 0.38
HPGD P15428 2/20 0.38
RECQL P46063 1/20 0.38
TDP1 Q9NUW8 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
KMT2A Q03164 3/20 0.37
ALDH1A1 P00352 2/20 0.37
MEN1 O00255 2/20 0.37
NFKB1 P19838 1/20 0.36
NFKB2 Q00653 1/20 0.36
RELA Q04206 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HSD17B10 Q99714 1/20 0.36
PLA2G1B P04054 1/20 0.36
ATM Q13315 1/20 0.36
ATG4B Q9Y4P1 1/20 0.36

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
SCHEMBL4690528 0.83 TDP1 (0.39) P2RX7EPHX2NPC1RAB9AHPGD
SCHEMBL4919046 0.81 KMT2A (0.50) EPHX2NPC1RAB9AHPGDTDP1
SCHEMBL4689965 0.79 TDP1 (0.44) P2RX7NPC1RAB9AHPGDTDP1
SCHEMBL4687682 0.77 EPHX2 (0.60) P2RX7EPHX2NPC1RAB9AHPGD
SCHEMBL4930927 0.69 KMT2A (0.51) EPHX2HPGDL3MBTL1KMT2AALDH1A1
SCHEMBL4688109 0.67 EPHX2 (0.57) P2RX7EPHX2NPC1RAB9AHPGD
SCHEMBL4693185 0.66 KMT2A (0.77) EPHX2NPC1RAB9AHPGDKMT2A
SCHEMBL4688031 0.64 EPHX2 (0.41) P2RX7EPHX2NPC1RAB9AKMT2A
SCHEMBL5320226 0.64 EPHX2 (0.49) EPHX2NPC1RAB9A
SCHEMBL9595984 0.64 EPHX2 (0.49) EPHX2NPC1RAB9AHPGDRECQL

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
EP-1443046-B1 NOVEL 4-(2FUROYL)AMINOPIPERIDINES, INTERMEDIATES IN SYNTHESIZING THE SAME, PROCESS FOR PRODUCING THE SAME AND MEDICINAL USE OF THE SAME KYORIN SEIYAKU KK (JP) 2008-12-17 EP disclosed
US-7375115-B2 4-(2-furoyl) aminopiperidines, intermediates in synthesizing the same, process for producing the same and medicinal use of the same KYORIN PHARMACEUTICAL CO., LTD. (JP) 2008-05-20 US disclosed
US-20050085508-A1 Novel 4-(2-furoyl) aminopiperidines, intermediates in synthesizing the same, process for producing the same and medicinal use of the same KYORIN PHARMACEUTICAL CO., LTD. (JP) 2005-04-21 US disclosed
EP-1443046-A1 NOVEL 4-(2FUROYL)AMINOPIPERIDINES, INTERMEDIATES IN SYNTHESIZING THE SAME, PROCESS FOR PRODUCING THE SAME AND MEDICINAL USE OF THE SAME Kyorin Pharmaceutical Co., Ltd. (JP) 2004-08-04 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-20050085508-A1 Novel 4-(2-furoyl) aminopiperidines, intermediates in synthesizing the same, process for producing the same and medicinal use of the same OPRM1, OPRD1, HRH4 P2RX7 352/4885EPHX2 510/4885NPC1 2992/4885

“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.