SCHEMBL24733191

SCHEMBL24733191

CC(C)N1CC[C@@H](O)[C@H](O)CC1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 1/20 0.39
HRH3 Q9Y5N1 13/20 0.38
KCNH2 Q12809 2/20 0.38
CYP2D6 P10635 2/20 0.38
ALDH1A1 P00352 2/20 0.36
KDM4E B2RXH2 1/20 0.34
MAPT P10636 1/20 0.34
PKM P14618 1/20 0.34
KDM1A O60341 1/20 0.33
GBA1 P04062 1/20 0.32

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
SCHEMBL24733229 1.00 CHRNA7 (0.39) CHRNA7HRH3KCNH2CYP2D6ALDH1A1
SCHEMBL24789555 1.00 CHRNA7 (0.39) CHRNA7HRH3KCNH2CYP2D6ALDH1A1
SCHEMBL24734655 1.00 CHRNA7 (0.39) CHRNA7HRH3KCNH2CYP2D6ALDH1A1
SCHEMBL12349918 0.87 GAA (0.35) CHRNA7HRH3KCNH2CYP2D6ALDH1A1
SCHEMBL21146123 0.87 GAA (0.35) CHRNA7HRH3KCNH2CYP2D6ALDH1A1
SCHEMBL21145786 0.87 GAA (0.35) CHRNA7HRH3KCNH2CYP2D6ALDH1A1
SCHEMBL21145787 0.87 GAA (0.35) CHRNA7HRH3KCNH2CYP2D6ALDH1A1
SCHEMBL26890013 0.85 CA1 (0.42) CHRNA7HRH3KCNH2CYP2D6ALDH1A1
SCHEMBL25125498 0.85 CA1 (0.42) CHRNA7HRH3KCNH2CYP2D6ALDH1A1
SCHEMBL26889902 0.85 CA1 (0.42) CHRNA7HRH3KCNH2CYP2D6ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11912723-B2 KRAS modulators and uses thereof QUANTA THERAPEUTICS, INC. (US) 2024-02-27 US disclosed
US-11912723-B2 KRAS modulators and uses thereof QUANTA THERAPEUTICS, INC. (US) 2024-02-27 US disclosed
WO-2023230190-A1 PYRIMIDINE BASED MODULATORS AND USES THEREOF QUANTA THERAPEUTICS, INC. (US) 2023-11-30 WO disclosed
US-20230374042-A1 KRAS MODULATORS AND USES THEREOF QUANTA THERAPEUTICS, INC. 2023-11-23 US disclosed
US-20230374042-A1 KRAS MODULATORS AND USES THEREOF QUANTA THERAPEUTICS, INC. 2023-11-23 US disclosed
WO-2023154766-A1 KRAS MODULATORS AND USES THEREOF QUANTA THERAPEUTICS, INC. (US) 2023-08-17 WO disclosed
WO-2022261210-A1 KRAS MODULATORS AND USES THEREOF QUANTA THERAPEUTICS, INC. (US) 2022-12-15 WO disclosed
WO-2022256459-A1 KRAS MODULATORS AND USES THEREOF QUANTA THERAPEUTICS, INC. (US) 2022-12-08 WO 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-20230374042-A1 KRAS MODULATORS AND USES THEREOF KRAS, NRAS, HRAS CHRNA7 4728/4885HRH3 2573/4885KCNH2 4497/4885
US-11912723-B2 KRAS modulators and uses thereof KRAS, NRAS, HRAS CHRNA7 4728/4885HRH3 2573/4885KCNH2 4497/4885

“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.