SCHEMBL2070104

SCHEMBL2070104

COC(=O)c1ccccc1N1CCCC(C(=O)O)C1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 4/20 0.53
HSD17B10 Q99714 5/20 0.48
KDM4E B2RXH2 5/20 0.48
TSHR P16473 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
POLB P06746 1/20 0.48
MAPT P10636 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
ALDH1A1 P00352 4/20 0.47
HPGD P15428 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
MYC P01106 1/20 0.46
TP53 P04637 1/20 0.44
SLC6A1 P30531 2/20 0.43
RECQL P46063 1/20 0.43

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
SCHEMBL15630869 0.84 GAA (0.53) HSD17B10KDM4ESMN1; SMN2POLBMAPT
SCHEMBL2069693 0.84 GABRA1 (0.48) HSD17B10KDM4ETSHRSMN1; SMN2POLB
SCHEMBL2069663 0.83 DPP4 (0.51) HSD17B10KDM4ESMN1; SMN2POLBALDH1A1
SCHEMBL23611760 0.83 MYC (0.47) HSD17B10KDM4ETSHRSMN1; SMN2POLB
SCHEMBL15630880 0.83 DPP4 (0.51) HSD17B10KDM4ESMN1; SMN2POLBALDH1A1
SCHEMBL2558871 0.83 NPC1 (0.61) NOTUMHSD17B10KDM4EALDH1A1MEN1
SCHEMBL2069146 0.81 PTPN1 (0.56) KDM4ESMN1; SMN2MAPTALDH1A1MEN1
SCHEMBL7328877 0.81 NOTUM (0.55) NOTUMHSD17B10KDM4EALDH1A1MEN1
SCHEMBL23708768 0.80 NPC1 (0.60) HSD17B10KDM4ETSHRSMN1; SMN2POLB
SCHEMBL20576073 0.80 MYC (0.49) NOTUMHSD17B10KDM4ETSHRSMN1; SMN2

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
US-7902367-B2 Cyclic amino benzoic acid derivative KYORIN PHARMACEUTICAL CO., LTD. (JP) 2011-03-08 US disclosed
US-7902367-B2 Cyclic amino benzoic acid derivative KYORIN PHARMACEUTICAL CO., LTD. (JP) 2011-03-08 US disclosed
US-7902367-B2 Cyclic amino benzoic acid derivative KYORIN PHARMACEUTICAL CO., LTD. (JP) 2011-03-08 US disclosed
US-20070249580-A1 Novel Cyclic Amino Benzoic Acid Derivative KYORIN PHARMACEUTICAL CO., LTD. (JP) 2007-10-25 US disclosed
US-20070249580-A1 Novel Cyclic Amino Benzoic Acid Derivative KYORIN PHARMACEUTICAL CO., LTD. (JP) 2007-10-25 US disclosed
US-20070249580-A1 Novel Cyclic Amino Benzoic Acid Derivative KYORIN PHARMACEUTICAL CO., LTD. (JP) 2007-10-25 US disclosed
CN-101014595-A Novel cyclic aminobenzoic acid derivative KYORIN SEIYAKU KK (JP) 2007-08-08 CN disclosed
EP-1780210-A1 NOVEL CYCLIC AMINOBENZOIC ACID DERIVATIVE Kyorin Pharmaceutical Co., Ltd. (JP) 2007-05-02 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-20070249580-A1 Novel Cyclic Amino Benzoic Acid Derivative PPARA, PPARG, PPARD NOTUM 1297/4885HSD17B10 304/4885KDM4E 1797/4885

“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.