SCHEMBL25857104

SCHEMBL25857104

NC1(CNC(=O)OCc2ccccc2)CCCCC1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CTSL P07711 1/20 0.53
CTSB P07858 1/20 0.53
CTSS P25774 1/20 0.53
LMNA P02545 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
ALDH1A1 P00352 1/20 0.52
CA12 O43570 2/20 0.50
CA1 P00915 2/20 0.50
CA2 P00918 2/20 0.50
CA9 Q16790 2/20 0.50
HTT P42858 1/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
PLAU P00749 1/20 0.47
SLC1A3 P43003 1/20 0.45
SLC1A1 P43005 1/20 0.45
TSHR P16473 1/20 0.45
EPHX1 P07099 1/20 0.45

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
SCHEMBL4549855 0.99 LMNA (0.54) CTSLCTSBCTSSLMNASMN1; SMN2
SCHEMBL15584548 0.86 LMNA (0.50) LMNASMN1; SMN2ALDH1A1CA12CA1
SCHEMBL30500926 0.86 LMNA (0.50) LMNASMN1; SMN2ALDH1A1CA12CA1
SCHEMBL25393509 0.84 SMN1; SMN2 (0.48) LMNASMN1; SMN2ALDH1A1CA12CA1
SCHEMBL10152341 0.83 CTSL (0.51) CTSLCTSBCTSSLMNASMN1; SMN2
SCHEMBL3647693 0.83 CTSL (0.53) CTSLCTSBCTSSLMNASMN1; SMN2
SCHEMBL4861409 0.83 CTSL (0.53) CTSLCTSBCTSSLMNASMN1; SMN2
SCHEMBL29845981 0.82 CTSS (0.58) CTSLCTSBCTSSLMNASMN1; SMN2
SCHEMBL16590476 0.81 FKBP1A (0.60) CTSLCTSBCTSSLMNASMN1; SMN2
Hydrochloric Acid SCHEMBL5601416 0.81 CTSS (0.57) CTSLCTSBCTSSLMNASMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024246713-A1 A PROCESS FOR THE PREPARATION OF CDK INHIBITING PYRROLOPYRIMIDINE COMPOUNDS FRESENIUS KABI ONCOLOGY LTD (IN) 2024-12-05 WO disclosed
US-11708337-B2 Synthesis of 1,4-diazaspiro[5.5]undecan-3-one G1 THERAPEUTICS, INC. (US) 2023-07-25 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 (1 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-11708337-B2 Synthesis of 1,4-diazaspiro[5.5]undecan-3-one NDC1, SDC1, SDC2 CTSL 2364/4885CTSB 3921/4885CTSS 2976/4885

“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.