SCHEMBL23966912

SCHEMBL23966912

CC(C)(C)c1nsc(NC(=O)Oc2ccccc2)n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCNE1 P24864 1/20 0.48
CDK2 P24941 1/20 0.48
CDK5 Q00535 1/20 0.48
ALDH1A1 P00352 9/20 0.47
KMT2A Q03164 7/20 0.46
MEN1 O00255 6/20 0.46
NPC1 O15118 3/20 0.46
RAB9A P51151 3/20 0.46
MAPT P10636 3/20 0.46
PKM P14618 1/20 0.46
POLB P06746 3/20 0.46
MIF P14174 1/20 0.46
SMN1; SMN2 Q16637 4/20 0.45
LMNA P02545 2/20 0.45
TP53 P04637 2/20 0.45
NFKB1 P19838 1/20 0.45
NFKB2 Q00653 1/20 0.45
RELA Q04206 1/20 0.45
GAA P10253 4/20 0.45
MAPK1 P28482 1/20 0.44

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
SCHEMBL77454 0.82 NPC1 (0.65) ALDH1A1KMT2AMEN1NPC1RAB9A
SCHEMBL5335555 0.82 ALDH1A1 (0.53) CCNE1CDK2CDK5ALDH1A1KMT2A
SCHEMBL15077769 0.80 ALDH1A1 (0.53) CCNE1CDK2CDK5ALDH1A1KMT2A
SCHEMBL29713757 0.79 ALDH1A1 (0.49) CCNE1CDK2CDK5ALDH1A1KMT2A
SCHEMBL15077546 0.78 RAB9A (0.55) CCNE1CDK2CDK5ALDH1A1KMT2A
SCHEMBL5336389 0.78 CCNE1 (0.57) CCNE1CDK2CDK5ALDH1A1KMT2A
SCHEMBL24491036 0.78 ALDH1A1 (0.61) CCNE1CDK2CDK5ALDH1A1KMT2A
SCHEMBL15077544 0.78 ALDH1A1 (0.56) CCNE1CDK2CDK5ALDH1A1KMT2A
SCHEMBL15077615 0.77 KMT2A (0.44) CCNE1CDK2CDK5ALDH1A1KMT2A
SCHEMBL8570631 0.76 ALDH1A1 (0.48) CCNE1CDK2CDK5ALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12091413-B2 Inhibitors of NEK7 kinase Halia Therapeutics, Inc. (US) 2024-09-17 US disclosed
EP-4146348-B1 INHIBITORS OF NEK7 KINASE HALIA THERAPEUTICS INC (US) 2024-07-03 EP disclosed
US-20230416259-A1 INHIBITORS OF NEK7 KINASE HALIA THERAPEUTICS INC (US) 2023-12-28 US disclosed
US-11713321-B2 Inhibitors of NEK7 kinase Halia Therapeutics, Inc. (US) 2023-08-01 US disclosed
US-11713321-B2 Inhibitors of NEK7 kinase Halia Therapeutics, Inc. (US) 2023-08-01 US disclosed
US-20230210853-A1 TARGETED NEK7 INHIBITION FOR MODULATION OF THE NLRP3 INFLAMMASOME Halia Therapeutics, Inc. 2023-07-06 US disclosed
US-20230210853-A1 TARGETED NEK7 INHIBITION FOR MODULATION OF THE NLRP3 INFLAMMASOME Halia Therapeutics, Inc. 2023-07-06 US disclosed
EP-4146348-A1 INHIBITORS OF NEK7 KINASE Halia Therapeutics, Inc. (US) 2023-03-15 EP disclosed
US-20220064173-A1 INHIBITORS OF NEK7 KINASE HALIA THERAPEUTICS INC (US) 2022-03-03 US disclosed
WO-2021242505-A1 INHIBITORS OF NEK7 KINASE Halia Therapeutics, Inc. (US) 2021-12-02 WO disclosed
US-20210355130-A1 INHIBITORS OF NEK7 KINASE Halia Therapeutics, Inc. 2021-11-18 US 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 (7 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-20210355130-A1 INHIBITORS OF NEK7 KINASE NEK7, NEK1, NEK5 CCNE1 2132/4885CDK2 694/4885CDK5 596/4885
US-11713321-B2 Inhibitors of NEK7 kinase NEK7, NEK1, NEK5 CCNE1 2132/4885CDK2 694/4885CDK5 596/4885
US-12091413-B2 Inhibitors of NEK7 kinase NEK7, NEK1, NEK5 CCNE1 2132/4885CDK2 694/4885CDK5 596/4885
US-20230210853-A1 TARGETED NEK7 INHIBITION FOR MODULATION OF THE NLRP3 INFLAMMASOME NEK7, NLRP3, NOD1 CCNE1 3951/4885CDK2 1707/4885CDK5 1180/4885
US-11161852-B1 Inhibitors of NEK7 kinase NEK7, NEK1, NEK5 CCNE1 2132/4885CDK2 694/4885CDK5 596/4885
US-20230416259-A1 INHIBITORS OF NEK7 KINASE NEK7, NEK1, NEK5 CCNE1 2132/4885CDK2 694/4885CDK5 596/4885
US-20220064173-A1 INHIBITORS OF NEK7 KINASE NEK7, NEK1, NEK5 CCNE1 2132/4885CDK2 694/4885CDK5 596/4885

“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.