SCHEMBL25993246

SCHEMBL25993246

CNCc1ccc(NC(=O)[C@H](C)NC(=O)C(NC)C(C)C)cc1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 4/20 0.40
▸ NPC1 O15118 2/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ GAA P10253 2/20 0.40
▸ MEN1 O00255 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ HTT P42858 1/20 0.38
▸ MMP13 P45452 1/20 0.38
▸ TP53 P04637 1/20 0.37
▸ SPHK1 Q9NYA1 1/20 0.37
▸ MAPK1 P28482 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ CRHBP P24387 1/20 0.36
▸ CRHR2 Q13324 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ FPR2 P25090 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
SCHEMBL24101234 1.00 SMN1; SMN2 (0.40) SMN1; SMN2NPC1RAB9AGAAMEN1
SCHEMBL24393471 0.90 MEN1 (0.39) SMN1; SMN2NPC1RAB9AGAAMEN1
SCHEMBL22561334 0.88 ADAMTS4 (0.41) SMN1; SMN2NPC1RAB9AGAAMEN1
SCHEMBL20733348 0.88 ADAMTS4 (0.41) SMN1; SMN2NPC1RAB9AGAAMEN1
SCHEMBL15099992 0.88 SMN1; SMN2 (0.48) SMN1; SMN2NPC1RAB9AGAAMEN1
SCHEMBL12285446 0.86 PLG (0.44) SMN1; SMN2NPC1RAB9AGAAMEN1
SCHEMBL18494908 0.84 SMN1; SMN2 (0.46) SMN1; SMN2NPC1RAB9AGAAMEN1
SCHEMBL25993243 0.84 NPC1 (0.43) SMN1; SMN2NPC1RAB9ASPHK1MAPT
SCHEMBL24279731 0.82 SMN1; SMN2 (0.45) SMN1; SMN2NPC1RAB9AMEN1KMT2A
SCHEMBL20258440 0.82 SMN1; SMN2 (0.45) SMN1; SMN2NPC1RAB9AGAAMEN1

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-20230355792-A1 METHODS OF IMPROVING THE THERAPEUTIC INDEX HEIDELBERG PHARMA RESEARCH GMBH (DE) 2023-11-09 — — US disclosed
US-20230233703-A1 AMANITIN CONJUGATES HEIDELBERG PHARMA RESEARCH GMBH (DE) 2023-07-27 — — 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 (2 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-20230355792-A1 METHODS OF IMPROVING THE THERAPEUTIC INDEX CD47, ANXA5, MTX1 SMN1; SMN2 1640/4885NPC1 2113/4885RAB9A 1307/4885
US-20230233703-A1 AMANITIN CONJUGATES CD47, MTX1, SIGLEC7 SMN1; SMN2 2480/4885NPC1 3747/4885RAB9A 1706/4885

“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.

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