SCHEMBL23966742

SCHEMBL23966742

CCC(CC)c1cc(C)on1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 1/20 0.41
NPC1 O15118 3/20 0.35
RAB9A P51151 3/20 0.35
GAA P10253 2/20 0.34
ALDH1A1 P00352 1/20 0.34
EGFR P00533 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
NPSR1 Q6W5P4 1/20 0.34
LMNA P02545 1/20 0.34
TP53 P04637 1/20 0.33
NFKB1 P19838 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33
CYP2C19 P33261 1/20 0.33
MAPT P10636 2/20 0.33
CXCR1 P25024 2/20 0.32
CXCR2 P25025 2/20 0.32
KLK7 P49862 3/20 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
SCHEMBL24960540 0.88 TRPM8 (0.36) TRPM8NPC1RAB9AGAAALDH1A1
SCHEMBL22818952 0.84 NR1I2 (0.35) TRPM8NPC1RAB9AALDH1A1TP53
SCHEMBL24959856 0.83 TRPM8 (0.38) TRPM8NPC1RAB9AGAAALDH1A1
SCHEMBL12310758 0.81 TRPM8 (0.44) TRPM8NPC1RAB9AGAAALDH1A1
SCHEMBL12261480 0.79 TRPM8 (0.38) TRPM8NPC1RAB9AGAAALDH1A1
SCHEMBL12261482 0.79 TRPM8 (0.38) TRPM8NPC1RAB9AGAAALDH1A1
SCHEMBL24027291 0.78 TRPM8 (0.41) TRPM8NPC1RAB9AGAAALDH1A1
SCHEMBL23565935 0.77 NPC1 (0.34) TRPM8NPC1RAB9AALDH1A1TP53
SCHEMBL23339950 0.77 NPC1 (0.34) TRPM8NPC1RAB9AALDH1A1TP53
SCHEMBL23966695 0.77 KDM4E (0.32) ALDH1A1MAPT

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
WO-2021252488-A1 INHIBITORS OF NEK7 KINASE Halia Therapeutics, Inc. (US) 2021-12-16 WO disclosed
WO-2021242505-A1 INHIBITORS OF NEK7 KINASE Halia Therapeutics, Inc. (US) 2021-12-02 WO disclosed
US-11161852-B1 Inhibitors of NEK7 kinase Halia Therapeutics, Inc. (US) 2021-11-02 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-11161852-B1 Inhibitors of NEK7 kinase NEK7, NEK1, NEK5 TRPM8 1239/4885NPC1 414/4885RAB9A 2987/4885

“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.