SCHEMBL2314224

SCHEMBL2314224

CCCc1c(C(=O)O)cc2c(c1O)C(=O)c1c(O)cccc1C2=O

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JUN P05412 1/20 0.69
FTO Q9C0B1 2/20 0.60
ELANE P08246 8/20 0.60
CTSG P08311 7/20 0.60
SLC37A4 O43826 3/20 0.60
ALDH1A1 P00352 3/20 0.53
MAPT P10636 3/20 0.53
TSHR P16473 3/20 0.53
TDP1 Q9NUW8 3/20 0.53
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
KDM4E B2RXH2 2/20 0.53
CYP3A4 P08684 2/20 0.53
RECQL P46063 2/20 0.53
LMNA P02545 2/20 0.53
HPGD P15428 2/20 0.53
ALOX15 P16050 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
HSD17B10 Q99714 2/20 0.53
TTR P02766 2/20 0.53

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
SCHEMBL16431884 0.81 JUN (1.00) JUNFTOELANECTSGSLC37A4
SCHEMBL5981442 0.81 FTO (0.68) JUNFTOELANECTSGSLC37A4
Anthraquinone SCHEMBL3670422 0.80 JUN (0.95) JUNFTOELANECTSGSLC37A4
SCHEMBL16431803 0.76 ELANE (0.62) JUNFTOELANECTSGSLC37A4
SCHEMBL28319049 0.74 SLC37A4 (0.51) JUNFTOELANESLC37A4ALDH1A1
SCHEMBL23723959 0.74 FTO (0.73) JUNFTOELANECTSGSLC37A4
SCHEMBL25211546 0.73 JUN (0.56) JUNFTOELANECTSGSLC37A4
SCHEMBL17867433 0.73 ELANE (0.62) JUNFTOELANECTSGSLC37A4
SCHEMBL16431638 0.73 ELANE (0.67) JUNFTOELANECTSGSLC37A4
Rhein SCHEMBL1356821 0.72 ALDH1A1 (0.97) JUNFTOELANEALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8951992-B2 Mycobacterium membrane protease as a target for inhibitors of intrabacterial pH homeostasis CORNELL UNIVERSITY (US) 2015-02-10 US disclosed
US-8951992-B2 Mycobacterium membrane protease as a target for inhibitors of intrabacterial pH homeostasis CORNELL UNIVERSITY (US) 2015-02-10 US disclosed
US-8951992-B2 Mycobacterium membrane protease as a target for inhibitors of intrabacterial pH homeostasis CORNELL UNIVERSITY (US) 2015-02-10 US disclosed
US-20110190234-A1 MYCOBACTERIUM MEMBRANE PROTEASE AS A TARGET FOR INHIBITORS OF INTRABACTERIAL pH HOMEOSTASIS CORNELL UNIVERSITY (US) 2011-08-04 US disclosed
US-20110190234-A1 MYCOBACTERIUM MEMBRANE PROTEASE AS A TARGET FOR INHIBITORS OF INTRABACTERIAL pH HOMEOSTASIS CORNELL UNIVERSITY (US) 2011-08-04 US disclosed
US-20110190234-A1 MYCOBACTERIUM MEMBRANE PROTEASE AS A TARGET FOR INHIBITORS OF INTRABACTERIAL pH HOMEOSTASIS CORNELL UNIVERSITY (US) 2011-08-04 US 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-20110190234-A1 MYCOBACTERIUM MEMBRANE PROTEASE AS A TARGET FOR INHIBITORS OF INTRABACTERIAL pH HOMEOSTASIS PREP, AFG3L2, TMPRSS15 JUN 1752/4885FTO 4885/4885ELANE 514/4885

“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.