SCHEMBL17320455

SCHEMBL17320455

Cc1ccc(CNCCN2CCN(C)CC2)c(C(F)(F)F)c1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.52
CACNA1G O43497 1/20 0.45
KIT P10721 5/20 0.44
POLB P06746 2/20 0.44
TSHR P16473 1/20 0.44
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
SRC P12931 2/20 0.41
ABL1 P00519 2/20 0.40
BRAF P15056 3/20 0.40
SLC2A1 P11166 1/20 0.39
DDR1 Q08345 2/20 0.39
EGFR P00533 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
SCHEMBL7923610 0.84 NR1H2 (0.72) NR1H2KITPOLBKDM4EALDH1A1
SCHEMBL15859934 0.83 KDM4E (0.63) NR1H2POLBTSHRKDM4EALDH1A1
SCHEMBL15847311 0.82 KIT (0.50) NR1H2KITPOLBTSHRSRC
SCHEMBL17311272 0.80 KIT (0.48) NR1H2KITPOLBTSHRSRC
SCHEMBL18403081 0.79 NR1H2 (0.42) NR1H2CACNA1GKITPOLBKDM4E
SCHEMBL15006475 0.79 POLB (0.69) NR1H2KITPOLBKDM4EALDH1A1
SCHEMBL15006474 0.76 NR1H2 (0.57) NR1H2KITPOLBKDM4EALDH1A1
SCHEMBL14317630 0.75 NR1H2 (0.56) NR1H2KITPOLBTSHRKDM4E
SCHEMBL11983616 0.73 DPP7 (0.54) POLBALDH1A1
SCHEMBL15785402 0.72 NR1H2 (0.56) NR1H2POLBTSHRKDM4EALDH1A1

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-9550772-B2 Azaindole derivatives as multi kinase inhibitors ORIBASE PHARMA (FR) 2017-01-24 US disclosed
US-9550772-B2 Azaindole derivatives as multi kinase inhibitors ORIBASE PHARMA (FR) 2017-01-24 US disclosed
US-9493455-B2 Azaindole derivatives as inhibitors of protein kinases ORIBASE PHARMA (FR) 2016-11-15 US disclosed
US-9493455-B2 Azaindole derivatives as inhibitors of protein kinases ORIBASE PHARMA (FR) 2016-11-15 US disclosed
US-9403823-B2 Protein kinase inhibitors ORIBASE PHARMA (FR) 2016-08-02 US disclosed
US-9403823-B2 Protein kinase inhibitors ORIBASE PHARMA (FR) 2016-08-02 US disclosed
US-20160009709-A1 PROTEIN KINASE INHIBITORS ORIBASE PHARMA (FR) 2016-01-14 US disclosed
US-20160009709-A1 PROTEIN KINASE INHIBITORS ORIBASE PHARMA (FR) 2016-01-14 US disclosed
US-20150353539-A1 AZAINDOLE DERIVATIVES AS MULTI KINASE INHIBITORS ORIBASE PHARMA (FR) 2015-12-10 US disclosed
US-20150353540-A1 AZAINDOLE DERIVATIVES AS INHIBITORS OF PROTEIN KINASES ORIBASE PHARMA (FR) 2015-12-10 US disclosed
US-20150353540-A1 AZAINDOLE DERIVATIVES AS INHIBITORS OF PROTEIN KINASES ORIBASE PHARMA (FR) 2015-12-10 US disclosed
US-20150353539-A1 AZAINDOLE DERIVATIVES AS MULTI KINASE INHIBITORS ORIBASE PHARMA (FR) 2015-12-10 US 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-20150353540-A1 AZAINDOLE DERIVATIVES AS INHIBITORS OF PROTEIN KINASES MAP3K5, MAP3K3, MAP3K20 NR1H2 4204/4885CACNA1G 4867/4885KIT 1108/4885
US-20150353539-A1 AZAINDOLE DERIVATIVES AS MULTI KINASE INHIBITORS MAP2K2, MAP2K5, MAP2K3 NR1H2 4130/4885CACNA1G 4832/4885KIT 836/4885
US-20160009709-A1 PROTEIN KINASE INHIBITORS MAP3K20, MAP3K1, MAP3K2 NR1H2 3112/4885CACNA1G 4870/4885KIT 1197/4885

“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.