SCHEMBL21483712

SCHEMBL21483712

OCC(O)(c1ccccc1)C1CCCC1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 6/20 0.58
CHRM1 P11229 5/20 0.58
CYP2D6 P10635 4/20 0.58
KCNH2 Q12809 4/20 0.58
CHRM3 P20309 3/20 0.58
CHRM4 P08173 2/20 0.58
CHRM5 P08912 2/20 0.58
TSHR P16473 2/20 0.58
GRIN2D O15399 1/20 0.58
GRIN3B O60391 1/20 0.58
HRH1 P35367 1/20 0.58
GRIN1 Q05586 1/20 0.58
GRIN2A Q12879 1/20 0.58
GRIN2B Q13224 1/20 0.58
GRIN2C Q14957 1/20 0.58
GRIN3A Q8TCU5 1/20 0.58
CYP3A4 P08684 1/20 0.58
NFKB1 P19838 1/20 0.58
TDP1 Q9NUW8 1/20 0.58
HTR1A P08908 1/20 0.58

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
SCHEMBL21483711 1.00 CHRM2 (0.58) CHRM2CHRM1CYP2D6KCNH2CHRM3
SCHEMBL1847210 0.98 CHRM2 (0.60) CHRM2CHRM1CYP2D6KCNH2CHRM3
SCHEMBL6700758 0.98 CHRM2 (0.60) CHRM2CHRM1CYP2D6KCNH2CHRM3
SCHEMBL6704158 0.98 CHRM2 (0.60) CHRM2CHRM1CYP2D6KCNH2CHRM3
SCHEMBL12441787 0.81 CHRM2 (0.66) CHRM2CHRM1CYP2D6KCNH2CHRM3
SCHEMBL2933098 0.81 CHRM2 (0.66) CHRM2CHRM1CYP2D6KCNH2CHRM3
SCHEMBL11161473 0.80 KEAP1 (0.57) CHRM2CHRM1CYP2D6KCNH2CHRM3
SCHEMBL2762931 0.79 CHRM2 (0.56) CHRM2CHRM1CYP2D6KCNH2CHRM3
SCHEMBL10392382 0.79 CHRM2 (0.64) CHRM2CHRM1CYP2D6KCNH2CHRM3
SCHEMBL10370745 0.79 CHRM2 (0.58) CHRM2CHRM1CYP2D6KCNH2CHRM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116046945-B Method for detecting related substances of penehyclidine hydrochloride injection by high performance liquid chromatography 上海旭东海普药业有限公司 2025-03-11 CN claimed
CN-116046945-A Method for detecting related substances of penehyclidine hydrochloride injection by high performance liquid chromatography 上海旭东海普药业有限公司 2023-05-02 CN claimed
CN-104090037-B A kind of detection method of catabolite of amyl ethyl quin ether hydrochloride CHENGDU LISITE PHARMACEUTICAL CO., LTD. (CN) 2015-12-30 CN claimed
CN-104090037-A Detection method of degradation product of penehyclidine hydrochloride CHENGDU LIST PHARMACEUTICAL CO LTD 2014-10-08 CN claimed
CN-116046945-B Method for detecting related substances of penehyclidine hydrochloride injection by high performance liquid chromatography 上海旭东海普药业有限公司 2025-03-11 CN disclosed
US-20230167107-A1 CRYSTALS, PREPARATION METHOD AND APPLICATION OF A MUSCARINIC RECEPTOR ANTAGONIST BEIJING SHOWBY PHARMACEUTICAL CO., LTD. (CN) 2023-06-01 US disclosed
US-20230167107-A1 CRYSTALS, PREPARATION METHOD AND APPLICATION OF A MUSCARINIC RECEPTOR ANTAGONIST BEIJING SHOWBY PHARMACEUTICAL CO., LTD. (CN) 2023-06-01 US disclosed
CN-116046945-A Method for detecting related substances of penehyclidine hydrochloride injection by high performance liquid chromatography 上海旭东海普药业有限公司 2023-05-02 CN disclosed
US-11447485-B2 Class of bifunctional compounds with quanternary ammonium salt structure BEIJING SHOWBY PHARMACEUTICAL CO., LTD. (CN) 2022-09-20 US disclosed
CN-110087729-B Bifunctional compound with quaternary ammonium salt structure 北京硕佰医药科技有限责任公司 2022-04-05 CN disclosed
EP-3556435-B1 CLASS OF BIFUNCTIONAL COMPOUNDS WITH QUATERNARY AMMONIUM SALT STRUCTURE BEIJING SHOWBY PHARMACEUTICAL CO LTD (CN) 2020-10-28 EP disclosed
EP-3556435-A1 CLASS OF BIFUNCTIONAL COMPOUNDS WITH QUATERNARY AMMONIUM SALT STRUCTURE Beijing Showby Pharmaceutical Co., Ltd. (CN) 2019-10-23 EP disclosed
CN-110087729-A One kind has the dual-function compound of quaternary ammonium salt structure 北京硕佰医药科技有限责任公司 2019-08-02 CN disclosed
CN-104090037-B A kind of detection method of catabolite of amyl ethyl quin ether hydrochloride CHENGDU LISITE PHARMACEUTICAL CO., LTD. (CN) 2015-12-30 CN disclosed
CN-104090037-B A kind of detection method of catabolite of amyl ethyl quin ether hydrochloride CHENGDU LISITE PHARMACEUTICAL CO., LTD. (CN) 2015-12-30 CN disclosed
CN-104090037-A Detection method of degradation product of penehyclidine hydrochloride CHENGDU LIST PHARMACEUTICAL CO LTD 2014-10-08 CN disclosed
CN-104090037-A Detection method of degradation product of penehyclidine hydrochloride CHENGDU LIST PHARMACEUTICAL CO LTD 2014-10-08 CN 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-11447485-B2 Class of bifunctional compounds with quanternary ammonium salt structure AGTR2, AGTR1, ADRB2 CHRM2 14/4885CHRM1 15/4885CYP2D6 1087/4885
US-20230167107-A1 CRYSTALS, PREPARATION METHOD AND APPLICATION OF A MUSCARINIC RECEPTOR ANTAGONIST CHRM5, CHRM2, CHRM3 CHRM2 2/4885CHRM1 5/4885CYP2D6 3292/4885

“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.