SCHEMBL12426532

SCHEMBL12426532

Cc1ccc(CN2CCCC2)c(C(F)(F)F)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.55
KDM4E B2RXH2 6/20 0.51
ALDH1A1 P00352 4/20 0.51
POLB P06746 2/20 0.51
ATM Q13315 3/20 0.48
NPSR1 Q6W5P4 3/20 0.48
KMT2A Q03164 3/20 0.48
TDP1 Q9NUW8 2/20 0.48
MEN1 O00255 1/20 0.48
GAA P10253 2/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.45
NR2E3 Q9Y5X4 1/20 0.45
MAPT P10636 1/20 0.44
CACNB4 O00305 1/20 0.44
CACNA1A O00555 1/20 0.44
CACNA1G O43497 1/20 0.44

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
SCHEMBL25745797 0.98 NR1H2 (0.54) NR1H2KDM4EALDH1A1POLBATM
SCHEMBL15006475 0.89 POLB (0.69) NR1H2KDM4EALDH1A1POLBATM
SCHEMBL7923610 0.88 NR1H2 (0.72) NR1H2KDM4EALDH1A1POLBATM
SCHEMBL15785402 0.88 NR1H2 (0.56) NR1H2KDM4EALDH1A1POLBATM
SCHEMBL14426354 0.87 KDM4E (0.51) NR1H2KDM4EALDH1A1POLBATM
SCHEMBL17320454 0.86 NR1H2 (0.51) NR1H2KDM4EALDH1A1POLBATM
SCHEMBL10104471 0.86 PDE3B (0.55) NR1H2KDM4EALDH1A1ATMNPSR1
SCHEMBL14426353 0.86 KDM4E (0.50) NR1H2KDM4EALDH1A1POLBATM
SCHEMBL15006474 0.85 NR1H2 (0.57) NR1H2KDM4EALDH1A1POLBATM
SCHEMBL14317630 0.84 NR1H2 (0.56) NR1H2KDM4EALDH1A1POLBATM

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
US-7977338-B2 Phenylacetamides being FLT3 inhibitors NOVARTIS AG (CH) 2011-07-12 US disclosed
US-7977338-B2 Phenylacetamides being FLT3 inhibitors NOVARTIS AG (CH) 2011-07-12 US disclosed
US-20100075980-A1 Phenylacetamides being FLT3 Inhibitors NOVARTIS AG (CH) 2010-03-25 US disclosed
US-20100075980-A1 Phenylacetamides being FLT3 Inhibitors NOVARTIS AG (CH) 2010-03-25 US disclosed
WO-2008046802-A1 PHENYLACETAMIDES USEFUL AS PROTEIN KINASE INHIBITORS NOVARTIS AG (CH) 2008-04-24 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-20100075980-A1 Phenylacetamides being FLT3 Inhibitors FLT3, JAK2, ABL1 NR1H2 2592/4885KDM4E 1104/4885ALDH1A1 3221/4885

“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.