SCHEMBL14938519

SCHEMBL14938519

Cc1nc(N2CCC(F)(F)C2)ccc1[N+](=O)[O-]

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.45
MAPT P10636 2/20 0.45
MAPK1 P28482 2/20 0.45
POLB P06746 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
GBA1 P04062 1/20 0.38
DPP4 P27487 1/20 0.36
NSD2 O96028 1/20 0.36
HPGD P15428 1/20 0.35
KLKB1 P03952 1/20 0.35
PDE10A Q9Y233 2/20 0.35
PTGER4 P35408 1/20 0.35
CRBN Q96SW2 1/20 0.34
LMNA P02545 1/20 0.34
CACNA1H O95180 1/20 0.34
KIF18A Q8NI77 1/20 0.33
SMPD3 Q9NY59 1/20 0.33

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
SCHEMBL14938517 0.92 MAPT (0.49) ALDH1A1MAPTMAPK1POLBTDP1
SCHEMBL2067936 0.89 MAPT (0.46) ALDH1A1MAPTMAPK1POLBTDP1
SCHEMBL2898709 0.79 MAPT (0.69) ALDH1A1MAPTMAPK1POLBTDP1
SCHEMBL2068371 0.79 MAPT (0.65) ALDH1A1MAPTMAPK1POLBTDP1
SCHEMBL31703634 0.77 MAPT (0.47) ALDH1A1MAPTMAPK1POLBTDP1
SCHEMBL14938681 0.76 DPP4 (0.39) GBA1DPP4NSD2KLKB1PDE10A
SCHEMBL2256829 0.75 MAPT (0.57) ALDH1A1MAPTMAPK1POLBTDP1
SCHEMBL14938740 0.75 MAPT (0.46) ALDH1A1MAPTMAPK1POLBTDP1
SCHEMBL14938603 0.75 MAPT (0.46) ALDH1A1MAPTMAPK1POLBTDP1
SCHEMBL31237010 0.73 LMNA (0.38) ALDH1A1MAPTMAPK1POLBTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2776445-B1 THERAPEUTICALLY ACTIVE THIAZOLO-PYRIMIDINE DERIVATIVES UCB BIOPHARMA SPRL (BE) 2016-08-10 EP disclosed
US-9096614-B2 Therapeutically active thiazolo-pyrimidine derivatives UCB PHARMA SA (BE) 2015-08-04 US disclosed
US-20140315885-A1 Therapeutically Active Thiazolo-Pyrimidine Derivatives UCB PHARMA SA (BE) 2014-10-23 US disclosed
EP-2776445-A1 THERAPEUTICALLY ACTIVE THIAZOLO-PYRIMIDINE DERIVATIVES UCB Pharma, S.A. (BE) 2014-09-17 EP disclosed
WO-2013068458-A1 THERAPEUTICALLY ACTIVE THIAZOLO-PYRIMIDINE DERIVATIVES UCB PHARMA S.A. (BE) 2013-05-16 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 (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-20140315885-A1 Therapeutically Active Thiazolo-Pyrimidine Derivatives TPMT, IFNG, IRF3 ALDH1A1 708/4885MAPT 2357/4885MAPK1 1831/4885

“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.