SCHEMBL1670079

SCHEMBL1670079

Nc1nc2c(s1)CN(c1ccc(C(F)(F)F)cn1)CC2

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.44
ABL1 P00519 1/20 0.44
LMNA P02545 1/20 0.44
RAD52 P43351 1/20 0.41
RECQL P46063 1/20 0.41
CYP3A4 P08684 1/20 0.41
MAPT P10636 4/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
GAA P10253 1/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
P2RX3 P56373 1/20 0.39
HPGD P15428 1/20 0.39
STS P08842 1/20 0.38
ALDH1A1 P00352 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38

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
SCHEMBL978017 0.77 HDAC1 (0.44) KDM4ELMNAMAPTSMN1; SMN2
SCHEMBL31143494 0.77 HDAC1 (0.44) KDM4ELMNAMAPTSMN1; SMN2
SCHEMBL17933911 0.76 GRIN2D (0.51) LMNARAD52RECQLMAPTGAA
SCHEMBL31143329 0.76 GRIN2D (0.51) LMNARAD52RECQLMAPTGAA
SCHEMBL31143411 0.75 RAD52 (0.45) KDM4ELMNARAD52RECQLMAPT
SCHEMBL31143467 0.74 HTT (0.54) KDM4ERAD52RECQLMAPTSMN1; SMN2
SCHEMBL31143330 0.72 RAD52 (0.47) KDM4ELMNARAD52RECQLMAPT
SCHEMBL31143408 0.71 RAD52 (0.44) KDM4ELMNARAD52RECQLMAPT
SCHEMBL31143551 0.70 RAD52 (0.48) KDM4ELMNARAD52RECQLMAPT
SCHEMBL2853594 0.70 P2RX3 (0.53) KDM4EABL1LMNAP2RX3

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
EP-2385948-B1 FUSED THIAZOLO AND OXAZOLO PYRIMIDINONES TORRENT PHARMACEUTICALS LTD (IN) 2017-10-04 EP disclosed
US-8822484-B2 Fused thiazolo and oxazolo pyrimidinones TORRENT PHARMACEUTICALS LIMITED (IN) 2014-09-02 US disclosed
US-20130331406-A1 NOVEL FUSED THIAZOLO AND OXAZOLO PYRIMIDINONES TORRENT PHARMACEUTICALS LIMITED (IN) 2013-12-12 US disclosed
US-8541430-B2 Fused thiazolo and oxazolo pyrimidinones TORRENT PHARMACEUTICALS LIMITED (IN) 2013-09-24 US disclosed
EP-2385948-A1 FUSED THIAZOLO AND OXAZOLO PYRIMIDINONES Torrent Pharmaceuticals Limited (IN) 2011-11-16 EP disclosed
US-20110130414-A1 NOVEL FUSED THIAZOLO AND OXAZOLO PYRIMIDINONES TORRENT PHARMACEUTICALS LIMITED (IN) 2011-06-02 US disclosed
WO-2011045811-A1 FUSED THIAZOLO AND OXAZOLO PYRIMIDINONES TORRENT PHARMACEUTICALS LIMITED (IN) 2011-04-21 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-20130331406-A1 NOVEL FUSED THIAZOLO AND OXAZOLO PYRIMIDINONES TPMT, TYMS, UGT1A8 KDM4E 4251/4885ABL1 2625/4885LMNA 3820/4885
US-20110130414-A1 NOVEL FUSED THIAZOLO AND OXAZOLO PYRIMIDINONES TPMT, ABCG2, TALDO1 KDM4E 4481/4885ABL1 1334/4885LMNA 3814/4885

“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.