SCHEMBL23709496

SCHEMBL23709496

CCC(=O)NCCN1CCN(C(C)C)CC1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 1/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.49
▸ HTR4 Q13639 1/20 0.44
▸ CYP2C19 P33261 1/20 0.44
▸ MEN1 O00255 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ SIGMAR1 Q99720 1/20 0.41
▸ HRH3 Q9Y5N1 2/20 0.41
▸ DRD2 P14416 2/20 0.40
▸ DRD3 P35462 2/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ MTNR1A P48039 1/20 0.39
▸ MTNR1B P49286 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ VCP P55072 1/20 0.39

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
SCHEMBL24530659 0.89 TP53 (0.56) TP53SMN1; SMN2MEN1KMT2ADRD2
SCHEMBL25477805 0.84 SMN1; SMN2 (0.44) TP53SMN1; SMN2HTR4MEN1KMT2A
SCHEMBL25913732 0.84 SMN1; SMN2 (0.44) TP53SMN1; SMN2HTR4MEN1KMT2A
SCHEMBL8145105 0.83 NPSR1 (0.47) TP53SMN1; SMN2HTR4CYP2C19SIGMAR1
SCHEMBL19586313 0.83 HTR4 (0.46) TP53SMN1; SMN2HTR4CYP2C19MEN1
SCHEMBL10109056 0.82 MEN1 (0.48) TP53SMN1; SMN2CYP2C19MEN1KMT2A
SCHEMBL15985650 0.82 HDAC2 (0.51) TP53SMN1; SMN2CYP2C19MEN1KMT2A
SCHEMBL84386 0.80 CA12 (0.55) SMN1; SMN2MEN1KMT2ANPC1
Hydrochloric Acid SCHEMBL23722070 0.79 CA12 (0.53) SMN1; SMN2MEN1KMT2ANPC1
SCHEMBL84849 0.79 ALDH1A1 (0.57) SMN1; SMN2MEN1KMT2ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11339144-B2 Heteroaryl Rheb inhibitors and uses thereof NAVITOR PHARMACEUTICALS, INC. (US) 2022-05-24 — — US disclosed
US-20210238165-A1 HETEROARYL RHEB INHIBITORS AND USES THEREOF NAVITOR PHARMACEUTICALS, INC. 2021-08-05 — — 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-20210238165-A1 HETEROARYL RHEB INHIBITORS AND USES THEREOF RHEB, KRAS, NRAS TP53 275/4885SMN1; SMN2 4200/4885HTR4 4630/4885
US-11339144-B2 Heteroaryl Rheb inhibitors and uses thereof RHEB, GDI2, KRAS TP53 1344/4885SMN1; SMN2 2458/4885HTR4 4794/4885

“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.

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