SCHEMBL21608573

SCHEMBL21608573

Cc1nc2c(N)c(C)ccc2[nH]1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.48
MAPT P10636 4/20 0.46
PARP1 P09874 3/20 0.45
ADRB2 P07550 1/20 0.42
POLB P06746 2/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
HTT P42858 1/20 0.39
RPS6KA3 P51812 1/20 0.37
ADORA3 P0DMS8 1/20 0.35
DHODH Q02127 1/20 0.35
ALDH1A1 P00352 3/20 0.35
KDM4E B2RXH2 1/20 0.35
NPC1 O15118 1/20 0.35
GLA P06280 1/20 0.35
GAA P10253 1/20 0.35
RAB9A P51151 1/20 0.35
GFER P55789 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35
CBFB Q13951 1/20 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
SCHEMBL6510341 0.81 PARP1 (0.42) MAPTPARP1ADRB2POLBMEN1
SCHEMBL13594653 0.80 ADRB2 (0.52) PARP1ADRB2HTTADORA3DHODH
SCHEMBL353026 0.79 CBFB (0.51) MAPTPARP1ADRB2HTTRPS6KA3
SCHEMBL6142607 0.76 RPS6KA3 (0.60) MAPTPARP1ADRB2POLBMEN1
SCHEMBL15500371 0.76 ADRB2 (0.42) PARP1ADRB2HTTADORA3DHODH
SCHEMBL3265280 0.76 HTT (0.47) MAPTPARP1ADRB2MEN1KMT2A
SCHEMBL5989876 0.76 ADRB2 (0.42) MAPTPARP1ADRB2HTTADORA3
SCHEMBL7032565 0.73 PARP1 (0.42) MAPTPARP1ADRB2POLBMEN1
SCHEMBL6507007 0.73 ALDH1A1 (0.57) MAPTPARP1ADRB2MEN1KMT2A
SCHEMBL6508965 0.73 PARP1 (0.42) MAPTPARP1ADRB2POLBMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210277003-A1 OGA INHIBITOR COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2021-09-09 US disclosed
WO-2019243535-A1 OGA INHIBITOR COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2019-12-26 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-20210277003-A1 OGA INHIBITOR COMPOUNDS OGA, OGT, GRN LMNA 848/4885MAPT 7/4885PARP1 345/4885

“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.