SCHEMBL20008973

SCHEMBL20008973

CC(C)N1CCN(C(=O)c2cncs2)C(C)C1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 1/20 0.54
LMNA P02545 1/20 0.42
ALOX15 P16050 1/20 0.42
TSHR P16473 1/20 0.42
HSD17B10 Q99714 1/20 0.42
HRH3 Q9Y5N1 2/20 0.41
GHSR Q92847 1/20 0.38
GRM5 P41594 8/20 0.38
HSP90AA1 P07900 2/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPT P10636 1/20 0.36
PKM P14618 1/20 0.36
ACACB O00763 4/20 0.34
PRKCB P05771 1/20 0.33

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
SCHEMBL20009014 0.84 PIK3CD (0.51) PIK3CDHRH3GRM5HSP90AA1ALDH1A1
SCHEMBL26241331 0.83 PIK3CD (0.51) PIK3CDLMNAALOX15TSHRHSD17B10
SCHEMBL22055016 0.78 PIK3CD (0.51) PIK3CDGRM5HSP90AA1ALDH1A1MAPT
SCHEMBL20009042 0.74 PIK3CD (0.50) PIK3CDHRH3GRM5HSP90AA1ALDH1A1
SCHEMBL20009023 0.73 PIK3CD (0.55) PIK3CDGHSRALDH1A1PKM
SCHEMBL20008988 0.73 PIK3CD (0.55) PIK3CDGHSRALDH1A1PKM
SCHEMBL20009029 0.73 PIK3CD (0.55) PIK3CDGHSRALDH1A1PKM
SCHEMBL19710931 0.73 PIK3CD (0.70) PIK3CDLMNAALOX15TSHRHSD17B10
SCHEMBL26243687 0.73 PRKCB (0.42) LMNAALOX15TSHRHSD17B10HRH3
SCHEMBL20009111 0.72 PIK3CD (0.38) PIK3CDHRH3ACACB

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 PIK3CD 3161/4885LMNA 1055/4885ALOX15 4460/4885
US-20180086720-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF SMARCC1, SMARCC2, SMARCA4 PIK3CD 3161/4885LMNA 1055/4885ALOX15 4460/4885

“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.