SCHEMBL2225581

SCHEMBL2225581

N#CCc1cc(-c2ccccc2)n(Cc2ccccc2)n1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC16A3 O15427 6/20 0.52
MCTS1 Q9ULC4 5/20 0.46
SLC16A1 P53985 4/20 0.45
SMN1; SMN2 Q16637 1/20 0.44
TSHR P16473 1/20 0.43
MALT1 Q9UDY8 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
GAA P10253 2/20 0.42
POLB P06746 1/20 0.42
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
CASP3 P42574 1/20 0.42
NR1H3 Q13133 1/20 0.42
SENP8 Q96LD8 1/20 0.42
SENP7 Q9BQF6 1/20 0.42
SENP6 Q9GZR1 1/20 0.42
HTR2C P28335 2/20 0.41
SLC6A4 P31645 2/20 0.41
HTR2A P28223 1/20 0.41
FLT3 P36888 1/20 0.40

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
SCHEMBL19586432 0.81 MPO (0.41) SMN1; SMN2ALDH1A1LMNAFLT3PTGS2
SCHEMBL2228029 0.80 SLC16A3 (0.48) SLC16A3MCTS1SLC16A1SMN1; SMN2TSHR
SCHEMBL2225688 0.80 SLC16A3 (0.59) SLC16A3MCTS1SLC16A1SMN1; SMN2MALT1
SCHEMBL2226540 0.80 SLC16A3 (0.56) SLC16A3MCTS1SLC16A1SMN1; SMN2MALT1
SCHEMBL27992969 0.77 SLC16A3 (0.53) SLC16A3MCTS1SLC16A1SMN1; SMN2MALT1
SCHEMBL2224515 0.75 SLC16A3 (0.49) SLC16A3MCTS1SLC16A1SMN1; SMN2TSHR
SCHEMBL28815520 0.72 SLC16A3 (0.51) SLC16A3MCTS1SLC16A1SMN1; SMN2MALT1
SCHEMBL5376898 0.72 RECQL (0.43) SMN1; SMN2TSHRGAAALDH1A1LMNA
SCHEMBL18301051 0.71 SLC16A3 (0.65) SLC16A3MCTS1SLC16A1SMN1; SMN2MALT1
SCHEMBL27992973 0.71 SLC16A3 (0.47) SLC16A3MCTS1SLC16A1SMN1; SMN2MALT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2533783-B1 COMPOUNDS AND METHODS for the inhibition of HDAC TEMPERO PHARMACEUTICALS INC (US) 2015-11-04 EP disclosed
EP-2533783-B1 COMPOUNDS AND METHODS for the inhibition of HDAC TEMPERO PHARMACEUTICALS INC (US) 2015-11-04 EP disclosed
US-20150038534-A1 COMPOUNDS AND METHODS TEMPERO PHARMACEUTICALS, INC. 2015-02-05 US disclosed
US-20150038534-A1 COMPOUNDS AND METHODS TEMPERO PHARMACEUTICALS, INC. 2015-02-05 US disclosed
US-20150038534-A1 COMPOUNDS AND METHODS TEMPERO PHARMACEUTICALS, INC. 2015-02-05 US disclosed
CN-103221047-B Compounds and methods TEMPERO PHARMACEUTICALS INC 2014-12-17 CN disclosed
US-8901156-B2 Compounds and methods TEMPERO PHARMACEUTICALS, INC. (US) 2014-12-02 US disclosed
US-8901156-B2 Compounds and methods TEMPERO PHARMACEUTICALS, INC. (US) 2014-12-02 US disclosed
US-8901156-B2 Compounds and methods TEMPERO PHARMACEUTICALS, INC. (US) 2014-12-02 US disclosed
CN-103221047-A Compounds and methods TEMPERO PHARMACEUTICALS INC 2013-07-24 CN disclosed
US-20130059883-A1 COMPOUNDS AND METHODS TEMPERO PHARMACEUTICALS, INC. 2013-03-07 US disclosed
US-20130059883-A1 COMPOUNDS AND METHODS TEMPERO PHARMACEUTICALS, INC. 2013-03-07 US disclosed
US-20130059883-A1 COMPOUNDS AND METHODS TEMPERO PHARMACEUTICALS, INC. 2013-03-07 US disclosed
WO-2011088181-A9 COMPOUNDS AND METHODS TEMPERO PHARMACEUTICALS, INC. (US) 2013-01-31 WO disclosed
WO-2011088181-A9 COMPOUNDS AND METHODS TEMPERO PHARMACEUTICALS, INC. (US) 2013-01-31 WO disclosed
EP-2533783-A1 COMPOUNDS AND METHODS Tempero Pharmaceuticals, Inc. (US) 2012-12-19 EP disclosed
WO-2011088181-A1 COMPOUNDS AND METHODS TEMPERO PHARMACEUTICALS, INC. (US) 2011-07-21 WO disclosed
WO-2011088181-A1 COMPOUNDS AND METHODS TEMPERO PHARMACEUTICALS, INC. (US) 2011-07-21 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-20150038534-A1 COMPOUNDS AND METHODS XDH, LPXN, CCNY SLC16A3 2990/4885MCTS1 3905/4885SLC16A1 4557/4885
US-20130059883-A1 COMPOUNDS AND METHODS XDH, LPXN, CCNY SLC16A3 2990/4885MCTS1 3905/4885SLC16A1 4557/4885

“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.