SCHEMBL30720936

SCHEMBL30720936

COc1ccc(-c2noc(C3CCN(C(=O)CNC(=O)OC(C)(C)C)CC3)n2)cc1OC

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMO Q99835 3/20 0.52
HTT P42858 2/20 0.51
MEN1 O00255 1/20 0.51
CYP3A4 P08684 1/20 0.51
CYP2C9 P11712 1/20 0.51
TSHR P16473 1/20 0.51
CYP2C19 P33261 1/20 0.51
KMT2A Q03164 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
USP2 O75604 1/20 0.50
LMNA P02545 1/20 0.50
TUBB4A P04350 1/20 0.46
TUBB P07437 1/20 0.46
TUBA3C P0DPH7 1/20 0.46
TUBA1B P68363 1/20 0.46
TUBA4A P68366 1/20 0.46
TUBB4B P68371 1/20 0.46
TUBB3 Q13509 1/20 0.46
TUBB2A Q13885 1/20 0.46
TUBB8 Q3ZCM7 1/20 0.46

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
SCHEMBL20116221 1.00 SMO (0.52) SMOHTTMEN1CYP3A4CYP2C9
SCHEMBL20660946 0.88 SMO (0.56) SMOHTTMEN1CYP3A4CYP2C9
SCHEMBL20116341 0.88 HTT (0.57) SMOHTTMEN1CYP3A4CYP2C9
SCHEMBL20116546 0.86 TSHR (0.49) SMOHTTMEN1CYP3A4CYP2C9
SCHEMBL30720940 0.86 TSHR (0.49) SMOHTTMEN1CYP3A4CYP2C9
SCHEMBL20116344 0.86 SMO (0.53) SMOHTTMEN1CYP3A4CYP2C9
SCHEMBL20116462 0.85 SMO (0.57) SMOHTTMEN1CYP3A4CYP2C9
SCHEMBL20116512 0.85 SMO (0.57) SMOHTTMEN1CYP3A4CYP2C9
SCHEMBL30720960 0.85 SMO (0.57) SMOHTTMEN1CYP3A4CYP2C9
SCHEMBL30506337 0.85 SMO (0.57) SMOHTTMEN1CYP3A4CYP2C9

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12275723-B2 Compounds and uses thereof JANSSEN PHARMACEUTICA NV (BE) 2025-04-15 US disclosed
US-20240400546-A1 COMPOUNDS AND USES THEREOF JANSSEN PHARMACEUTICA NV (BE) 2024-12-05 US disclosed
US-20240300938-A1 COMPOUNDS AND USES THEREOF JANSSEN PHARMACEUTICA NV (BE) 2024-09-12 US disclosed
US-11970486-B2 Compounds and uses thereof JANSSEN PHARMACEUTICA NV (BE) 2024-04-30 US disclosed
US-20240124435-A1 COMPOUNDS AND USES THEREOF JANSSEN PHARMACEUTICA NV (BE) 2024-04-18 US disclosed
US-11873298-B2 Compounds and uses thereof JANSSEN PHARMACEUTICA NV (BE) 2024-01-16 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 (6 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-20240124435-A1 COMPOUNDS AND USES THEREOF NLN, ACHE, CLN6 SMO 1858/4885HTT 6/4885MEN1 1807/4885
US-20240300938-A1 COMPOUNDS AND USES THEREOF NLN, ACHE, CLN6 SMO 1858/4885HTT 6/4885MEN1 1807/4885
US-11873298-B2 Compounds and uses thereof NLN, ACHE, CLN6 SMO 1858/4885HTT 6/4885MEN1 1807/4885
US-20240400546-A1 COMPOUNDS AND USES THEREOF NLN, ACHE, CLN6 SMO 1858/4885HTT 6/4885MEN1 1807/4885
US-12275723-B2 Compounds and uses thereof NLN, ACHE, CLN6 SMO 1858/4885HTT 6/4885MEN1 1807/4885
US-11970486-B2 Compounds and uses thereof NLN, ACHE, CLN6 SMO 1858/4885HTT 6/4885MEN1 1807/4885

“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.