SCHEMBL22002181

SCHEMBL22002181

Cc1ccc2cc(Br)c(NCC3CC3)nc2c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.45
ALDH1A1 P00352 3/20 0.45
HSD17B10 Q99714 3/20 0.45
LRRK2 Q5S007 1/20 0.39
KMT2A Q03164 5/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
IRAK4 Q9NWZ3 1/20 0.38
CYP1A2 P05177 1/20 0.37
GAA P10253 3/20 0.36
MEN1 O00255 2/20 0.36
GLA P06280 1/20 0.36
HPGD P15428 1/20 0.36
TSHR P16473 1/20 0.36
PRKCQ Q04759 1/20 0.36
CASP1 P29466 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
TLR7 Q9NYK1 1/20 0.36
VCP P55072 3/20 0.36
PDE5A O76074 2/20 0.35

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
SCHEMBL18572137 0.83 TLR7 (0.36) LRRK2PRKCQTLR7PDE5A
SCHEMBL30159403 0.81 TLR7 (0.47) ALDH1A1KMT2AMEN1GLAHPGD
SCHEMBL18572136 0.72 SOS1 (0.38) PRKCQTLR7
SCHEMBL22002290 0.72 TLR7 (0.39) KDM4EALDH1A1LRRK2KMT2AMEN1
SCHEMBL30159461 0.72
SCHEMBL22509756 0.71 KMT2A (0.47) KDM4EALDH1A1HSD17B10KMT2ANPC1
SCHEMBL22509623 0.69 KMT2A (0.43) KDM4EALDH1A1HSD17B10KMT2ANPC1
SCHEMBL13438851 0.69 MET (0.45) ALDH1A1KMT2ANPC1RAB9AIRAK4
SCHEMBL31184381 0.68 MEN1 (0.44) KDM4EALDH1A1LRRK2KMT2AIRAK4
SCHEMBL24271449 0.66 AKT1 (0.34) PRKCQ

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
EP-4219496-A1 NOVEL 6-6 BICYCLIC AROMATIC RING SUBSTITUTED NUCLEOSIDE ANALOGUES FOR USE AS PRMT5 INHIBITORS JANSSEN Pharmaceutica NV (BE) 2023-08-02 EP disclosed
US-11318157-B2 6-6 bicyclic aromatic ring substituted nucleoside analogues for use as PRMT5 inhibitors JANSSEN PHARMACEUTICA NV (BE) 2022-05-03 US disclosed
EP-3341368-B1 NOVEL 6-6 BICYCLIC AROMATIC RING SUBSTITUTED NUCLEOSIDE ANALOGUES FOR USE AS PRMT5 INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2021-10-06 EP disclosed
US-20200360416-A1 NOVEL 6-6 BICYCLIC AROMATIC RING SUBSTITUTED NUCLEOSIDE ANALOGUES FOR USE AS PRMT5 INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2020-11-19 US disclosed
US-10653711-B2 6-6 bicyclic aromatic ring substituted nucleoside analogues for use as PRMT5 inhibitors JANSSEN PHARMACEUTICA NV (BE) 2020-05-19 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 (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-11318157-B2 6-6 bicyclic aromatic ring substituted nucleoside analogues for use as PRMT5 inhibitors PRMT5, PRMT6, PRMT1 KDM4E 47/4885ALDH1A1 3170/4885HSD17B10 4116/4885
US-20200360416-A1 NOVEL 6-6 BICYCLIC AROMATIC RING SUBSTITUTED NUCLEOSIDE ANALOGUES FOR USE AS PRMT5 INHIBITORS PRMT5, PRMT6, PRMT1 KDM4E 40/4885ALDH1A1 3370/4885HSD17B10 3920/4885
US-10653711-B2 6-6 bicyclic aromatic ring substituted nucleoside analogues for use as PRMT5 inhibitors PRMT5, PRMT6, PRMT1 KDM4E 47/4885ALDH1A1 3170/4885HSD17B10 4116/4885

“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.