SCHEMBL22357963

SCHEMBL22357963

Cc1nn(C)c2cc(-c3nsc(C4CCN(C(=O)CNC(=O)c5ccccc5)CC4)n3)ccc12

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.43
LDHA P00338 2/20 0.41
THRA P10827 1/20 0.37
VDR P11473 1/20 0.37
SCD5 Q86SK9 2/20 0.37
RAB9A P51151 1/20 0.36
KMT2A Q03164 1/20 0.36
LMNA P02545 1/20 0.36
P2RY12 Q9H244 2/20 0.36
EGLN1 Q9GZT9 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
SCHEMBL26997540 0.90 GRM4 (0.38) P2RY12EGLN1
SCHEMBL22358360 0.90 RORC (0.43)
SCHEMBL30552726 0.84 TUBB4A (0.50) SMN1; SMN2LDHALMNA
SCHEMBL20116129 0.84 TUBB4A (0.50) SMN1; SMN2LDHALMNA
SCHEMBL22357989 0.82 LDHA (0.54) SMN1; SMN2LDHASCD5
SCHEMBL20116114 0.82 SMN1; SMN2 (0.52) SMN1; SMN2LDHAP2RY12
SCHEMBL26999735 0.81 TUBB4A (0.47) SMN1; SMN2LDHARAB9ALMNA
SCHEMBL20116960 0.78 GPR119 (0.43) SCD5KMT2A
SCHEMBL22358346 0.78 LDHA (0.40) SMN1; SMN2LDHATHRAVDRRAB9A
SCHEMBL20116109 0.78 TUBB4A (0.50) SMN1; SMN2LDHALMNA

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 SMN1; SMN2 13/4885LDHA 1044/4885THRA 4557/4885
US-20200262828-A1 COMPOUNDS AND USES THEREOF NLN, ACHE, CLN6 SMN1; SMN2 13/4885LDHA 1044/4885THRA 4557/4885

“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.