SCHEMBL5539470

SCHEMBL5539470

C=NN(C(=O)CNc1cccc(C(=O)Nc2ccccc2)c1)c1c(Cl)cncc1Cl

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRK2 P25098 8/20 0.59
GRK3 P35626 5/20 0.59
GRK5 P34947 3/20 0.59
KMT2A Q03164 4/20 0.42
MEN1 O00255 3/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
MAPT P10636 2/20 0.42
LMNA P02545 1/20 0.42
ROCK2 O75116 1/20 0.41
PRKCA P17252 1/20 0.41
KCNK3 O14649 3/20 0.40
KCNK9 Q9NPC2 2/20 0.40
NPC1 O15118 3/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC2 Q92769 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
RAB9A P51151 2/20 0.39
NFKB1 P19838 1/20 0.39
NFKB2 Q00653 1/20 0.39

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
SCHEMBL5535879 0.82 GRK2 (0.57) GRK2GRK3GRK5KMT2AMEN1
SCHEMBL5539419 0.82 GRK2 (0.57) GRK2GRK3GRK5SMN1; SMN2RAB9A
SCHEMBL5537585 0.79 GRK2 (0.65) GRK2SMN1; SMN2POLB
SCHEMBL5539702 0.79 GRK2 (0.59) GRK2GRK3GRK5KMT2AMEN1
SCHEMBL5545993 0.76 GRK2 (0.59) GRK2GRK3MAPTLMNAROCK2
SCHEMBL14496438 0.74 GRK2 (1.00) GRK2GRK3GRK5
SCHEMBL5543418 0.72 GRK2 (0.56) GRK2GRK3GRK5KMT2AMEN1
SCHEMBL5539705 0.71 GRK2 (0.56) GRK2GRK3GRK5SMN1; SMN2MAPT
SCHEMBL14496495 0.70 GRK2 (0.78) GRK2GRK3GRK5ROCK2
SCHEMBL5329635 0.68 GRK2 (0.55) GRK2GRK3GRK5KMT2AMEN1

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-20070135499-A1 Hydrazide compounds AERIE PHARMACEUTICALS, INC. (US) 2007-06-14 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-20070135499-A1 Hydrazide compounds GRK4, GRK2, GRK1 GRK2 2/4885GRK3 4/4885GRK5 5/4885

“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.