SCHEMBL28529378

SCHEMBL28529378

COC(=O)c1ccc(C2C[C@@H](O)CCN2C(=O)OCc2ccccc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 7/20 0.47
TMEM97 Q5BJF2 6/20 0.47
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
PDE4B Q07343 1/20 0.43
KDM1A O60341 1/20 0.43
RCOR1 Q9UKL0 1/20 0.43

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
SCHEMBL24179625 1.00 SIGMAR1 (0.47) SIGMAR1TMEM97NPC1RAB9ASMN1; SMN2
SCHEMBL30053112 1.00 SIGMAR1 (0.47) SIGMAR1TMEM97NPC1RAB9ASMN1; SMN2
SCHEMBL30052834 1.00 SIGMAR1 (0.47) SIGMAR1TMEM97NPC1RAB9ASMN1; SMN2
SCHEMBL29148961 1.00 SIGMAR1 (0.47) SIGMAR1TMEM97NPC1RAB9ASMN1; SMN2
SCHEMBL28540053 1.00 SIGMAR1 (0.47) SIGMAR1TMEM97NPC1RAB9ASMN1; SMN2
SCHEMBL16409317 0.89 SIGMAR1 (0.46) SIGMAR1TMEM97NPC1RAB9ASMN1; SMN2
SCHEMBL29148988 0.89 SIGMAR1 (0.46) SIGMAR1TMEM97NPC1RAB9ASMN1; SMN2
SCHEMBL29148979 0.89 SIGMAR1 (0.46) SIGMAR1TMEM97NPC1RAB9ASMN1; SMN2
SCHEMBL29213769 0.89 SIGMAR1 (0.46) SIGMAR1TMEM97NPC1RAB9ASMN1; SMN2
SCHEMBL17782309 0.89 SIGMAR1 (0.46) SIGMAR1TMEM97NPC1RAB9ASMN1; SMN2

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-11578053-B2 Chemical process for preparing phenylpiperidinyl indole derivatives NOVARTIS AG (CH) 2023-02-14 US disclosed
US-20220169630-A1 CHEMICAL PROCESS FOR PREPARING PHENYLPIPERIDINYL INDOLE DERIVATIVES NOVARTIS AG (CH) 2022-06-02 US disclosed
CN-112513025-A Chemical process for the preparation of phenylpiperidinylindole derivatives 诺华股份有限公司 2021-03-16 CN 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-20220169630-A1 CHEMICAL PROCESS FOR PREPARING PHENYLPIPERIDINYL INDOLE DERIVATIVES IDO1, CYP3A7, PAH SIGMAR1 1700/4885TMEM97 3511/4885NPC1 1271/4885
US-11578053-B2 Chemical process for preparing phenylpiperidinyl indole derivatives IDO1, CYP3A7, PAH SIGMAR1 1700/4885TMEM97 3511/4885NPC1 1271/4885

“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.