SCHEMBL2391276

SCHEMBL2391276

CCOC(=O)c1cc2cc(OS(=O)(=O)C(F)(F)F)ccc2[nH]1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.67
ALDH1A1 P00352 3/20 0.67
HPGD P15428 3/20 0.67
RAB9A P51151 3/20 0.67
NPC1 O15118 2/20 0.67
LMNA P02545 2/20 0.67
HTT P42858 1/20 0.67
L3MBTL1 Q9Y468 1/20 0.67
SMN1; SMN2 Q16637 2/20 0.61
HSD17B10 Q99714 1/20 0.61
HRH3 Q9Y5N1 1/20 0.60
MMP13 P45452 7/20 0.58
MMP2 P08253 5/20 0.58
GAA P10253 2/20 0.56
KMT2A Q03164 2/20 0.56
MEN1 O00255 1/20 0.56
GLA P06280 1/20 0.56
MAPT P10636 1/20 0.56
ATM Q13315 1/20 0.56
MMP14 P50281 3/20 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
SCHEMBL213638 0.86 XDH (0.63) KDM4EALDH1A1HPGDRAB9ANPC1
SCHEMBL384385 0.85 KDM4E (0.74) KDM4EALDH1A1HPGDRAB9ANPC1
SCHEMBL9254874 0.81 KDM4E (0.65) KDM4EALDH1A1HPGDRAB9ANPC1
SCHEMBL75327 0.81 KDM4E (1.00) KDM4EALDH1A1HPGDRAB9ANPC1
SCHEMBL9263164 0.81 KDM4E (0.80) KDM4EALDH1A1HPGDRAB9ANPC1
SCHEMBL31287683 0.80 KDM4E (0.66) KDM4EALDH1A1HPGDRAB9ANPC1
SCHEMBL6001740 0.79 MMP13 (0.75) KDM4EALDH1A1HPGDRAB9ANPC1
SCHEMBL6002237 0.79 KDM4E (0.58) KDM4EALDH1A1HPGDRAB9ANPC1
SCHEMBL5841102 0.79 KDM4E (0.72) KDM4EALDH1A1HPGDRAB9ANPC1
SCHEMBL6300554 0.79 XDH (0.74) KDM4EALDH1A1HPGDRAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE42700-E1 Induction of apoptosis in cancer cells SANFORD-BURNHAM MEDICAL RESEARCH INSTITUTE (US) 2011-09-13 US disclosed
US-20100130737-A1 Regulating Agent of GPR34 Receptor Function TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-05-27 US disclosed
EP-1849465-A1 AGENT FOR CONTROLLING FUNCTION OF GPR34 RECEPTOR Takeda Pharmaceutical Company Limited (JP) 2007-10-31 EP disclosed
US-7053071-B2 For therapy of leukemia or other forms of cancer or for treating disease conditions caused by apoptosis of cells THE BURNHAM INSTITUTE (US) 2006-05-30 US disclosed
EP-1456165-A1 INDUCTION OF APOPTOSIS IN CANCER CELLS The Burnham Institute (US) 2004-09-15 EP disclosed
US-20030176506-A1 Induction of apoptosis in cancer cells BURNHAM INSTITUTE FOR MEDICAL RESEARCH 2003-09-18 US disclosed
WO-2003048101-A1 INDUCTION OF APOPTOSIS IN CANCER CELLS THE BURNHAM INSTITUTE (US) 2003-06-12 WO 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-20100130737-A1 Regulating Agent of GPR34 Receptor Function GPR34, GPR4, GPR6 KDM4E 2059/4885ALDH1A1 3047/4885HPGD 1550/4885
US-20030176506-A1 Induction of apoptosis in cancer cells MCL1, BAD, BCL2 KDM4E 2860/4885ALDH1A1 1651/4885HPGD 803/4885

“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.