SCHEMBL20008967

SCHEMBL20008967

CC(C)N1CCN(C(=O)c2ccccc2)C(C)C1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SMO Q99835 9/20 0.50
HTT P42858 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
PIK3CD O00329 1/20 0.49
ACHE P22303 1/20 0.45
GAA P10253 1/20 0.45
HPGD P15428 1/20 0.45
TSHR P16473 1/20 0.45
RECQL P46063 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
GHSR Q92847 1/20 0.44

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
SCHEMBL26239985 0.84 PIK3CD (0.58) L3MBTL1PIK3CDACHETSHRRECQL
SCHEMBL20008988 0.84 PIK3CD (0.55) SMOHTTL3MBTL1PIK3CDGAA
SCHEMBL20009029 0.84 PIK3CD (0.55) SMOHTTL3MBTL1PIK3CDGAA
SCHEMBL20009023 0.84 PIK3CD (0.55) SMOHTTL3MBTL1PIK3CDGAA
SCHEMBL252505 0.81 ACHE (0.55) SMOHTTL3MBTL1PIK3CDACHE
SCHEMBL18080914 0.80 SMO (0.53) SMOHTTL3MBTL1ACHEGAA
SCHEMBL26814614 0.80 HTT (0.56) SMOHTTL3MBTL1PIK3CDACHE
SCHEMBL10938522 0.79 ACHE (0.53) SMOHTTL3MBTL1PIK3CDACHE
SCHEMBL3712727 0.79 HTT (0.62) SMOHTTL3MBTL1ACHEGAA
SCHEMBL26243687 0.78 PRKCB (0.42) SMOHTTL3MBTL1TSHR

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-10308614-B2 Therapeutic compounds and uses thereof GENENTECH, INC. (US) 2019-06-04 US disclosed
US-20180086720-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2018-03-29 US disclosed
US-20180086720-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2018-03-29 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-10308614-B2 Therapeutic compounds and uses thereof SMARCC1, SMARCC2, SMARCA4 SMO 1332/4885HTT 832/4885L3MBTL1 555/4885
US-20180086720-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF SMARCC1, SMARCC2, SMARCA4 SMO 1332/4885HTT 832/4885L3MBTL1 555/4885

“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.