SCHEMBL22358562

SCHEMBL22358562

CC(C)n1ncc2ccc(-c3nc(C4CCN(C(=O)c5ccccc5Cl)CC4)no3)cc21

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 4/20 0.49
SMN1; SMN2 Q16637 2/20 0.48
HTR4 Q13639 2/20 0.41
TP53 P04637 1/20 0.41
UBE2M P61081 1/20 0.41
DCUN1D1 Q96GG9 1/20 0.41
RAB9A P51151 1/20 0.39
USP7 Q93009 1/20 0.39
EGLN1 Q9GZT9 1/20 0.39
USP30 Q70CQ3 1/20 0.39
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
GAA P10253 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
SCHEMBL20116225 0.89 SMN1; SMN2 (0.41) HSD11B1SMN1; SMN2HTR4USP7USP30
SCHEMBL20116787 0.87 SMN1; SMN2 (0.45) HSD11B1SMN1; SMN2HTR4RAB9AUSP7
SCHEMBL20116073 0.86 SMN1; SMN2 (0.41) HSD11B1SMN1; SMN2HTR4USP7USP30
SCHEMBL20116077 0.85 SMN1; SMN2 (0.39) HSD11B1SMN1; SMN2HTR4USP7USP30
SCHEMBL22357857 0.85 HSD11B1 (0.54) HSD11B1SMN1; SMN2ALDH1A1
SCHEMBL20116783 0.85 SMN1; SMN2 (0.41) SMN1; SMN2HTR4USP7EGLN1USP30
SCHEMBL20116456 0.85 GBA1 (0.44) KDM4EALDH1A1
SCHEMBL20116228 0.85 HSD11B1 (0.47) HSD11B1SMN1; SMN2TP53UBE2MDCUN1D1
SCHEMBL20116779 0.84 RAB9A (0.44) HSD11B1SMN1; SMN2UBE2MDCUN1D1RAB9A
SCHEMBL20116506 0.83 SMO (0.42) SMN1; SMN2HTR4RAB9AUSP7USP30

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 HSD11B1 1676/4885SMN1; SMN2 13/4885HTR4 482/4885
US-20200262828-A1 COMPOUNDS AND USES THEREOF NLN, ACHE, CLN6 HSD11B1 1676/4885SMN1; SMN2 13/4885HTR4 482/4885

“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.