SCHEMBL22688944

SCHEMBL22688944

CCCCCCCCCCCCCCCCCCCC[Mg]Br

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.50
THRB P10828 1/20 0.50
DNM1 Q05193 7/20 0.38
ALDH1A1 P00352 3/20 0.38
LMNA P02545 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
HSD17B10 Q99714 1/20 0.38
SLC22A1 O15245 1/20 0.38
EPHX1 P07099 1/20 0.38

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
SCHEMBL3888518 1.00 TSHR (0.50) TSHRTHRBDNM1ALDH1A1LMNA
SCHEMBL305260 1.00
SCHEMBL10533402 1.00 TSHR (0.50) TSHRTHRBDNM1ALDH1A1LMNA
SCHEMBL4514650 1.00 TSHR (0.50) TSHRTHRBDNM1ALDH1A1LMNA
SCHEMBL7043940 1.00 TSHR (0.50) TSHRTHRBDNM1ALDH1A1LMNA
SCHEMBL305184 1.00 TSHR (0.50) TSHRTHRBDNM1ALDH1A1LMNA
SCHEMBL305058 1.00 TSHR (0.50) TSHRTHRBDNM1ALDH1A1LMNA
SCHEMBL153016 1.00
SCHEMBL2145601 1.00 TSHR (0.50) TSHRTHRBDNM1ALDH1A1LMNA
SCHEMBL31404556 1.00 TSHR (0.50) TSHRTHRBDNM1ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12617749-B2 Cannabinoid derivatives and precursors, and asymmetric synthesis for same KARE CHEMICAL TECHNOLOGIES INC. (CA) 2026-05-05 US disclosed
EP-4464685-B1 PROCESS FOR PREPARING 17-METHYLALKANE COMPOUND SHINETSU CHEMICAL CO (JP) 2026-02-04 EP disclosed
EP-4464685-A1 PROCESS FOR PREPARING 17-METHYLALKANE COMPOUND SHIN-ETSU CHEMICAL CO., LTD. (JP) 2024-11-20 EP disclosed
US-20240368056-A1 PROCESS FOR PREPARING 17-METHYLALKANE COMPOUND SHIN-ETSU CHEMICAL CO., LTD. (JP) 2024-11-07 US disclosed
CN-118878394-A Method for preparing 17-methylalkane compound 信越化学工业株式会社 2024-11-01 CN disclosed
US-20220340514-A1 CANNABINOID DERIVATIVES AND PRECURSORS, AND ASYMMETRIC SYNTHESIS FOR SAME KARE CHEMICAL TECHNOLOGIES INC. (CA) 2022-10-27 US disclosed
US-20220220089-A1 CATALYTIC CANNABINOID PROCESSES AND PRECURSORS KARE CHEMICAL TECHNOLOGIES INC. (CA) 2022-07-14 US disclosed
CN-114269717-A Catalytic cannabinoid processes and precursors 凯尔化学科技公司 2022-04-01 CN disclosed
EP-3959193-A1 CATALYTIC CANNABINOID PROCESSES AND PRECURSORS Kare Chemical Technologies Inc. (CA) 2022-03-02 EP disclosed
WO-2021046640-A1 CANNABINOID DERIVATIVES AND PRECURSORS, AND ASYMMETRIC SYNTHESIS FOR SAME KARE CHEMICAL TECHNOLOGIES INC. (CA) 2021-03-18 WO disclosed
WO-2020232545-A1 CATALYTIC CANNABINOID PROCESSES AND PRECURSORS KARE CHEMICAL TECHNOLOGIES INC. (CA) 2020-11-26 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 (4 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-20220340514-A1 CANNABINOID DERIVATIVES AND PRECURSORS, AND ASYMMETRIC SYNTHESIS FOR SAME CNR2, CNR1, CYP2A13 TSHR 3763/4885THRB 4422/4885DNM1 1009/4885
US-20220220089-A1 CATALYTIC CANNABINOID PROCESSES AND PRECURSORS CNR1, CNR2, FAAH TSHR 3997/4885THRB 4441/4885DNM1 935/4885
US-20240368056-A1 PROCESS FOR PREPARING 17-METHYLALKANE COMPOUND CYP4Z1, CYP51A1, MSMO1 TSHR 4372/4885THRB 4192/4885DNM1 2623/4885
US-12617749-B2 Cannabinoid derivatives and precursors, and asymmetric synthesis for same CNR1, CNR2, OPRD1 TSHR 1324/4885THRB 2166/4885DNM1 1956/4885

“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.