SCHEMBL7035140

SCHEMBL7035140

CCOC(=O)c1cn(CCCCN)c2cc(Cl)c(F)cc2c1=O

nearest known ligand 0.62

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.57
POLB P06746 1/20 0.54
ALDH1A1 P00352 4/20 0.51
KDM4E B2RXH2 3/20 0.51
HPGD P15428 2/20 0.51
HSD17B10 Q99714 2/20 0.51
LMNA P02545 2/20 0.47
TEAD2 Q15562 1/20 0.46
MAPT P10636 1/20 0.43
NPC1 O15118 1/20 0.43
BAZ2B Q9UIF8 1/20 0.43
BAZ2A Q9UIF9 1/20 0.43
P2RX3 P56373 1/20 0.42
CNR1 P21554 2/20 0.41
CNR2 P34972 1/20 0.41
STAT3 P40763 1/20 0.41

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
SCHEMBL7041173 0.91 KMT2A (0.56) KMT2APOLBALDH1A1KDM4EHPGD
SCHEMBL11398510 0.88 KMT2A (0.60) KMT2APOLBALDH1A1KDM4EHPGD
SCHEMBL11067835 0.88 KMT2A (0.60) KMT2APOLBALDH1A1KDM4EHPGD
SCHEMBL8041564 0.87 POLB (0.69) KMT2APOLBALDH1A1KDM4EHPGD
SCHEMBL29823822 0.87 POLB (0.69) KMT2APOLBALDH1A1KDM4EHPGD
SCHEMBL29576801 0.83 KMT2A (0.56) KMT2APOLBALDH1A1KDM4EHPGD
SCHEMBL11402926 0.83 KMT2A (0.56) KMT2APOLBALDH1A1KDM4EHPGD
SCHEMBL17775892 0.83 KMT2A (0.62) KMT2APOLBALDH1A1KDM4EHPGD
SCHEMBL4659798 0.83 KMT2A (0.54) KMT2APOLBALDH1A1KDM4EHPGD
SCHEMBL10923394 0.82 KMT2A (0.55) KMT2APOLBALDH1A1KDM4EHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030114445-A1 N3-substituted 6-anilinopyrimidines and methods to treat-Gram-positive bacterial and mycoplasmal infections NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2003-06-19 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 (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-20030114445-A1 N3-substituted 6-anilinopyrimidines and methods to treat-Gram-positive bacterial and mycoplasmal infections MPHOSPH6, MRPS18A, PNP KMT2A 2098/4885POLB 243/4885ALDH1A1 3453/4885

“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.