SCHEMBL22754469

SCHEMBL22754469

CC(C)(C)OC(=O)NCCN1CCC(F)C1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CACNA1H O95180 1/20 0.49
DRD2 P14416 10/20 0.47
EPHX1 P07099 1/20 0.45
CCNT1 O60563 1/20 0.44
CDK9 P50750 1/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
GAA P10253 1/20 0.43
JAK2 O60674 1/20 0.43
JAK1 P23458 1/20 0.43
TDP1 Q9NUW8 1/20 0.42
ALDH1A1 P00352 1/20 0.40
TSHR P16473 1/20 0.40
SIGMAR1 Q99720 1/20 0.39

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
SCHEMBL18233674 1.00 CACNA1H (0.49) CACNA1HDRD2EPHX1CCNT1CDK9
SCHEMBL18233672 1.00 CACNA1H (0.49) CACNA1HDRD2EPHX1CCNT1CDK9
SCHEMBL18233679 0.90 CACNA1H (0.49) CACNA1HDRD2EPHX1MEN1KMT2A
SCHEMBL20479436 0.87 CACNA1H (0.48) CACNA1HDRD2EPHX1CCNT1CDK9
SCHEMBL20480232 0.87 CACNA1H (0.48) CACNA1HDRD2EPHX1CCNT1CDK9
SCHEMBL28665379 0.87 CACNA1H (0.48) CACNA1HDRD2EPHX1CCNT1CDK9
SCHEMBL31420611 0.86 CACNA1H (0.49) CACNA1HDRD2EPHX1CCNT1CDK9
SCHEMBL14197690 0.86 CACNA1H (0.49) CACNA1HDRD2EPHX1CCNT1CDK9
SCHEMBL18233684 0.85 DRD2 (0.47) CACNA1HDRD2EPHX1MEN1KMT2A
SCHEMBL14614740 0.84 CACNA1H (0.53) CACNA1HDRD2EPHX1JAK2JAK1

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-11999728-B2 Estrogen receptor modulators RECURIUM IP HOLDINGS, LLC (US) 2024-06-04 US disclosed
EP-4267578-A1 ESTROGEN RECEPTOR MODULATORS Recurium IP Holdings, LLC (US) 2023-11-01 EP disclosed
US-20220235050-A1 ESTROGEN RECEPTOR MODULATORS RECURIUM IP HOLDINGS, LLC 2022-07-28 US disclosed
WO-2022140744-A1 ESTROGEN RECEPTOR MODULATORS RECURIUM IP HOLDINGS, LLC (US) 2022-06-30 WO disclosed
WO-2022140744-A1 ESTROGEN RECEPTOR MODULATORS RECURIUM IP HOLDINGS, LLC (US) 2022-06-30 WO disclosed
US-11339162-B1 Estrogen receptor modulators RECURIUM IP HOLDINGS, LLC (US) 2022-05-24 US disclosed
US-11339162-B1 Estrogen receptor modulators RECURIUM IP HOLDINGS, LLC (US) 2022-05-24 US disclosed
EP-3747892-A1 GLUCOPYRANOSYL DERIVATIVE AND USE THEREOF Sunshine Lake Pharma Co., Ltd. (CN) 2020-12-09 EP 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 (3 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-11339162-B1 Estrogen receptor modulators ESR2, GPER1, ESRRA CACNA1H 3698/4885DRD2 4568/4885EPHX1 783/4885
US-11999728-B2 Estrogen receptor modulators ESR2, GPER1, ESRRA CACNA1H 3698/4885DRD2 4568/4885EPHX1 783/4885
US-20220235050-A1 ESTROGEN RECEPTOR MODULATORS ESR2, GPER1, ESRRA CACNA1H 3698/4885DRD2 4568/4885EPHX1 783/4885

“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.