SCHEMBL22357989

SCHEMBL22357989

Cc1nn(C)c2cc(-c3nc(C4CCN(C(=O)CNC(=O)c5ccccc5)CC4)no3)ccc12

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LDHA P00338 2/20 0.54
SMN1; SMN2 Q16637 1/20 0.42
SCD5 Q86SK9 2/20 0.40
USP7 Q93009 1/20 0.39
KIT P10721 1/20 0.39
MGLL Q99685 1/20 0.38

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
SCHEMBL20116129 0.87 TUBB4A (0.50) LDHASMN1; SMN2
SCHEMBL30552726 0.87 TUBB4A (0.50) LDHASMN1; SMN2
SCHEMBL20117147 0.85 USP7 (0.45) SMN1; SMN2SCD5USP7KIT
SCHEMBL26999735 0.84 TUBB4A (0.47) LDHASMN1; SMN2
SCHEMBL22358021 0.83 USP7 (0.43) SMN1; SMN2SCD5USP7
SCHEMBL22357963 0.82 SMN1; SMN2 (0.43) LDHASMN1; SMN2SCD5
SCHEMBL20117144 0.82 USP7 (0.45) SMN1; SMN2SCD5USP7
SCHEMBL22358230 0.82 USP7 (0.45) SMN1; SMN2SCD5USP7KIT
SCHEMBL30506294 0.81 LDHA (0.58) LDHASMN1; SMN2
SCHEMBL20116115 0.81 LDHA (0.58) LDHASMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11873298-B2 Compounds and uses thereof JANSSEN PHARMACEUTICA NV (BE) 2024-01-16 US disclosed
US-11873298-B2 Compounds and uses thereof JANSSEN PHARMACEUTICA NV (BE) 2024-01-16 US disclosed
US-20200262828-A1 COMPOUNDS AND USES THEREOF JANSSEN PHARMACEUTICA NV (BE) 2020-08-20 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-11873298-B2 Compounds and uses thereof NLN, ACHE, CLN6 LDHA 1044/4885SMN1; SMN2 13/4885SCD5 1575/4885
US-20200262828-A1 COMPOUNDS AND USES THEREOF NLN, ACHE, CLN6 LDHA 1044/4885SMN1; SMN2 13/4885SCD5 1575/4885

“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.