SCHEMBL24734679

SCHEMBL24734679

CC(C)N1CCC[C@H](O)[C@@H](O)C1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAN2B1 O00754 1/20 0.36
DRD2 P14416 1/20 0.36
DRD3 P35462 1/20 0.36
KDM2B Q8NHM5 1/20 0.35
SLC18A3 Q16572 2/20 0.33
KAT2B Q92831 1/20 0.33
PARP1 P09874 2/20 0.32
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA4 P22748 1/20 0.31
HRH3 Q9Y5N1 2/20 0.30
CYP2D6 P10635 1/20 0.30
KCNH2 Q12809 1/20 0.30

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
SCHEMBL24734677 1.00 MAN2B1 (0.36) MAN2B1DRD2DRD3KDM2BSLC18A3
SCHEMBL24789557 1.00 MAN2B1 (0.36) MAN2B1DRD2DRD3KDM2BSLC18A3
SCHEMBL12349918 0.86 GAA (0.35) HRH3CYP2D6KCNH2
SCHEMBL21145787 0.86 GAA (0.35) HRH3CYP2D6KCNH2
SCHEMBL21146123 0.86 GAA (0.35) HRH3CYP2D6KCNH2
SCHEMBL21145786 0.86 GAA (0.35) HRH3CYP2D6KCNH2
SCHEMBL26889994 0.83 CA1 (0.43) MAN2B1DRD2DRD3KDM2BKAT2B
SCHEMBL21146441 0.82 MAN2B1 (0.33) MAN2B1DRD2DRD3KDM2BKAT2B
SCHEMBL21146202 0.82 DRD2 (0.33) DRD2DRD3KDM2BKAT2B
SCHEMBL27305028 0.82 DRD2 (0.36) MAN2B1DRD2DRD3KDM2BKAT2B

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 6 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
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-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 MAN2B1 1322/4885DRD2 4639/4885DRD3 4417/4885
US-11912723-B2 KRAS modulators and uses thereof KRAS, NRAS, HRAS MAN2B1 1322/4885DRD2 4639/4885DRD3 4417/4885

“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.