SCHEMBL15769252

SCHEMBL15769252

CC(C)(C)OC(=O)N1C(C)(C)CC(O)CC1(C)C

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.46
CHRM1 P11229 1/20 0.46
CHRM3 P20309 1/20 0.46
EPHX2 P34913 1/20 0.38
USP2 O75604 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
CTSK P43235 1/20 0.37
NR1H2 P55055 2/20 0.36
HPGD P15428 1/20 0.35
KDM1A O60341 1/20 0.33
BUB1 O43683 1/20 0.33
RECQL P46063 1/20 0.33
EPHX1 P07099 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
PREP P48147 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
SCHEMBL27228212 0.86 CHRM2 (0.39) CHRM2CHRM1CHRM3EPHX2USP2
SCHEMBL1964183 0.84 KDM1A (0.38) CHRM2CHRM1CHRM3EPHX2USP2
SCHEMBL21162862 0.84 CHRM2 (0.38) CHRM2CHRM1CHRM3EPHX2USP2
SCHEMBL9893515 0.83 CHRM2 (0.32) CHRM2CHRM1CHRM3
SCHEMBL30277219 0.82 CHRM2 (0.44) CHRM2CHRM1CHRM3EPHX2USP2
SCHEMBL25148013 0.80 CHRM2 (0.45) CHRM2CHRM1CHRM3EPHX2USP2
SCHEMBL20973202 0.79 CHRM2 (0.44) CHRM2CHRM1CHRM3EPHX2USP2
SCHEMBL21274860 0.79 CHRM2 (0.44) CHRM2CHRM1CHRM3EPHX2USP2
SCHEMBL27228213 0.77 CHRM2 (0.42) CHRM2CHRM1CHRM3EPHX2USP2
SCHEMBL16468545 0.77 CTSK (0.42) CHRM2CHRM1CHRM3EPHX2USP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240173439-A1 FLUORINE-CONTAINING COMPOUND AND CONTRAST MEDIUM TDK CORPORATION (JP) 2024-05-30 US disclosed
EP-2743271-B1 PIM KINASE INHIBITORS AND PREPARATION METHOD AND USE IN MEDICINAL MANUFACTURE THEREOF JIKAI BIOSCIENCES INC (CN) 2017-05-31 EP disclosed
US-9090594-B2 PIM kinase inhibitors and preparation methods and use in medicinal manufacture thereof Jikai Biosciences, Inc. (CN) 2015-07-28 US disclosed
EP-2743271-A1 PIM KINASE INHIBITOR AND PREPARATION METHOD AND USE IN MEDICINAL MANUFACTURE THEREOF Jikai Biosciences Inc. (CN) 2014-06-18 EP disclosed
US-20140162999-A1 PIM KINASE INHIBITORS AND PREPARATION METHODS AND USE IN MEDICINAL MANUFACTURE THEREOF Jikai Biosciences, Inc. (CN) 2014-06-12 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 (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-20140162999-A1 PIM KINASE INHIBITORS AND PREPARATION METHODS AND USE IN MEDICINAL MANUFACTURE THEREOF PIM1, PIM2, PIM3 CHRM2 4194/4885CHRM1 3107/4885CHRM3 3950/4885
US-20240173439-A1 FLUORINE-CONTAINING COMPOUND AND CONTRAST MEDIUM AFF1, AFF2, AFF4 CHRM2 112/4885CHRM1 41/4885CHRM3 282/4885

“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.