SCHEMBL14677603

SCHEMBL14677603

Cc1ccc(C(C(=O)O)c2ccccc2)c(C)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.48
MEN1 O00255 4/20 0.48
CACNA2D1 P54289 4/20 0.47
CACNA1B Q00975 4/20 0.47
CACNB1 Q02641 4/20 0.47
CACNA1C Q13936 2/20 0.47
CACNA1G O43497 1/20 0.47
BRD4 O60885 1/20 0.43
L3MBTL1 Q9Y468 3/20 0.42
ATM Q13315 1/20 0.42
CNR1 P21554 1/20 0.41
CNR2 P34972 1/20 0.41
ALDH1A1 P00352 2/20 0.41
HTT P42858 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
NFE2L2 Q16236 1/20 0.40
CYP2D6 P10635 1/20 0.39
SRC P12931 1/20 0.39

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
SCHEMBL9306566 0.90 KMT2A (0.48) KMT2AMEN1CACNA2D1CACNA1BCACNB1
SCHEMBL7864024 0.87 MEN1 (0.44) KMT2AMEN1CACNA2D1CACNA1BCACNB1
SCHEMBL21641668 0.85 KMT2A (0.36) KMT2AMEN1CACNA2D1CACNA1BCACNB1
SCHEMBL14677560 0.83 TSHR (0.45) KMT2AMEN1L3MBTL1CNR1ALDH1A1
SCHEMBL3630774 0.82 ACP3 (0.53) KMT2AMEN1L3MBTL1ALDH1A1TDP1
SCHEMBL4619006 0.81 KMT2A (0.54) KMT2AMEN1CACNA1CCNR1CNR2
SCHEMBL4619827 0.81 MEN1 (0.45) KMT2AMEN1L3MBTL1ALDH1A1
SCHEMBL4776740 0.79 SLC6A2 (0.47) KMT2AMEN1L3MBTL1CNR1CNR2
SCHEMBL1551142 0.77 CNR1 (0.56) KMT2AMEN1L3MBTL1CNR1CNR2
SCHEMBL4273855 0.77 MLKL (0.47) KMT2AMEN1CACNA2D1CACNA1BCACNB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140256740-A1 COMPOUNDS AND METHODS TEMPERO PHARMACEUTICALS, INC. (US) 2014-09-11 US disclosed
US-20140256740-A1 COMPOUNDS AND METHODS TEMPERO PHARMACEUTICALS, INC. (US) 2014-09-11 US disclosed
US-20140256740-A1 COMPOUNDS AND METHODS TEMPERO PHARMACEUTICALS, INC. (US) 2014-09-11 US disclosed
US-20140155381-A1 COMPOUNDS AND METHODS TEMPERO PHARMACEUTICALS, INC. 2014-06-05 US disclosed
US-20140155419-A1 COMPOUNDS AND METHODS TEMPERO PHARMACEUTICALS, INC. 2014-06-05 US disclosed
US-20140155381-A1 COMPOUNDS AND METHODS TEMPERO PHARMACEUTICALS, INC. 2014-06-05 US disclosed
US-20140155381-A1 COMPOUNDS AND METHODS TEMPERO PHARMACEUTICALS, INC. 2014-06-05 US disclosed
US-20140155419-A1 COMPOUNDS AND METHODS TEMPERO PHARMACEUTICALS, INC. 2014-06-05 US disclosed
US-20140155419-A1 COMPOUNDS AND METHODS TEMPERO PHARMACEUTICALS, INC. 2014-06-05 US disclosed
EP-2736332-A1 COMPOUNDS AND METHODS Tempero Pharmaceuticals, Inc. (US) 2014-06-04 EP disclosed
WO-2013019653-A1 COMPOUNDS AND METHODS TEMPERO PHARMACEUTICALS, INC. (US) 2013-02-07 WO disclosed
WO-2013019653-A1 COMPOUNDS AND METHODS TEMPERO PHARMACEUTICALS, INC. (US) 2013-02-07 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 (3 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-20140256740-A1 COMPOUNDS AND METHODS RORC, RORB, RORA KMT2A 1686/4885MEN1 4672/4885CACNA2D1 3189/4885
US-20140155381-A1 COMPOUNDS AND METHODS RORC, RORB, RORA KMT2A 1686/4885MEN1 4672/4885CACNA2D1 3189/4885
US-20140155419-A1 COMPOUNDS AND METHODS RORC, RORB, RORA KMT2A 1686/4885MEN1 4672/4885CACNA2D1 3189/4885

“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.