SCHEMBL23749976

SCHEMBL23749976

CN(CC(=O)N1CCCc2ccccc21)Cc1nc2ccccc2c(=O)[nH]1

nearest known ligand 0.72

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.61
MAPT P10636 3/20 0.57
KMT2A Q03164 2/20 0.53
ALPL P05186 1/20 0.53
ALPI P09923 1/20 0.53
ALDH1A1 P00352 11/20 0.52
LMNA P02545 5/20 0.52
SMN1; SMN2 Q16637 3/20 0.52
HTT P42858 3/20 0.52
NPSR1 Q6W5P4 3/20 0.51
TSHR P16473 3/20 0.51
ALOX15 P16050 2/20 0.51
MEN1 O00255 1/20 0.48
TP53 P04637 1/20 0.48
MAPK1 P28482 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
KDM4E B2RXH2 2/20 0.48
RXFP1 Q9HBX9 1/20 0.48

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
SCHEMBL26521632 0.84 PARP1 (0.54) PARP1MAPTKMT2AALPLALPI
SCHEMBL30132100 0.84 PARP1 (0.54) PARP1MAPTKMT2AALPLALPI
SCHEMBL26521647 0.84 PARP1 (0.54) PARP1MAPTKMT2AALPLALPI
SCHEMBL26524354 0.83 MAPT (0.51) PARP1MAPTKMT2AALPLALPI
SCHEMBL23723748 0.83 MAPT (0.51) PARP1MAPTKMT2AALPLALPI
SCHEMBL23723559 0.83 ALDH1A1 (0.52) PARP1MAPTKMT2AALPLALPI
SCHEMBL26523474 0.81 ALDH1A1 (0.65) MAPTKMT2AALDH1A1LMNASMN1; SMN2
SCHEMBL30132060 0.81 KMT2A (0.60) PARP1MAPTKMT2AALPLALPI
SCHEMBL26521975 0.79 MAPT (0.46) MAPTALDH1A1SMN1; SMN2HTTNPSR1
SCHEMBL30132126 0.78 TSHR (0.48) PARP1MAPTALDH1A1LMNASMN1; SMN2

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-20230140216-A1 COMBINATION THERAPY FOR TREATING MPS1 GAIN THERAPEUTICS SA (CH) 2023-05-04 US disclosed
US-20230140216-A1 COMBINATION THERAPY FOR TREATING MPS1 GAIN THERAPEUTICS SA (CH) 2023-05-04 US disclosed
US-20230140216-A1 COMBINATION THERAPY FOR TREATING MPS1 GAIN THERAPEUTICS SA (CH) 2023-05-04 US disclosed
CN-115397423-A Combination therapy for the treatment of MPS1 增益治疗股份有限公司 2022-11-25 CN disclosed
WO-2021156774-A1 COMBINATION THERAPY FOR TREATING MPS1 GAIN THERAPEUTICS SA (CH) 2021-08-12 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-20230140216-A1 COMBINATION THERAPY FOR TREATING MPS1 IDUA, MAN2B1, GBA1 PARP1 3379/4885MAPT 2501/4885KMT2A 3761/4885

“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.