SCHEMBL30163507

SCHEMBL30163507

CC(=O)N1/C(=C\c2ccc3cc(C(=O)N4CCN(C(=O)OC(C)(C)C)CC4)ccc3n2)C(=O)c2ccccc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
ALDH1A1 P00352 1/20 0.40
MAPT P10636 1/20 0.40
HTT P42858 1/20 0.40
AKT1 P31749 1/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
CNR2 P34972 1/20 0.38
CCNC P24863 1/20 0.37
CDK8 P49336 1/20 0.37
SMARCA2 P51531 1/20 0.37
SMARCA4 P51532 1/20 0.37
PBRM1 Q86U86 1/20 0.37
HDAC4 P56524 1/20 0.37
CRBN Q96SW2 1/20 0.37
GPR119 Q8TDV5 1/20 0.36
BACE1 P56817 2/20 0.36
PDK1 Q15118 1/20 0.36

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
SCHEMBL24976072 0.91 AKT1 (0.38) MAPK1SMN1; SMN2ALDH1A1MAPTAKT1
SCHEMBL30163525 0.89 ALDH1A1 (0.38) MAPK1SMN1; SMN2TDP1ALDH1A1MAPT
SCHEMBL31428617 0.87 ALDH1A1 (0.45) MAPK1SMN1; SMN2TDP1ALDH1A1MAPT
SCHEMBL30163521 0.86 ALDH1A1 (0.45) MAPK1SMN1; SMN2TDP1ALDH1A1MAPT
SCHEMBL31428538 0.86 HPGD (0.46) MAPK1SMN1; SMN2TDP1ALDH1A1MAPT
SCHEMBL31428440 0.85 ALDH1A1 (0.43) MAPK1SMN1; SMN2TDP1ALDH1A1MAPT
Hydrochloric Acid SCHEMBL31428503 0.85 ALDH1A1 (0.43) MAPK1SMN1; SMN2TDP1ALDH1A1MAPT
SCHEMBL31428867 0.84 PKM (0.44) MAPK1SMN1; SMN2TDP1ALDH1A1MAPT
SCHEMBL30163546 0.84 MAPT (0.41) MAPK1SMN1; SMN2TDP1ALDH1A1MAPT
SCHEMBL31428674 0.83 ALDH1A1 (0.40) MAPK1SMN1; SMN2TDP1ALDH1A1MAPT

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-20250091994-A1 RAS/RAF BINDING INHIBITOR COMPOUND NATIONAL UNIVERSITY CORPORATION KOBE UNIVERSITY (JP) 2025-03-20 US disclosed
WO-2023008577-A1 RAS/RAF BINDING INHIBITOR COMPOUND 国立大学法人神戸大学 2023-02-02 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-20250091994-A1 RAS/RAF BINDING INHIBITOR COMPOUND BRAF, RAF1, NRAS MAPK1 140/4885SMN1; SMN2 4832/4885TDP1 3630/4885

“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.