SCHEMBL6353029

SCHEMBL6353029

COc1cccc(C2CCN(Cc3ccccc3)C2)c1

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 4/20 0.62
SIGMAR1 Q99720 3/20 0.62
CHRM4 P08173 1/20 0.60
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
HTR1A P08908 1/20 0.51
SLC6A4 P31645 1/20 0.51
MCHR1 Q99705 1/20 0.51
NR3C1 P04150 1/20 0.51
NR3C2 P08235 1/20 0.51
ACHE P22303 1/20 0.50

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
SCHEMBL22928142 1.00 DRD2 (0.62) DRD2SIGMAR1CHRM4MEN1KMT2A
SCHEMBL2851870 0.92 DRD2 (0.70) DRD2SIGMAR1CHRM4MEN1KMT2A
Hydrochloric Acid SCHEMBL10352098 0.91 DRD2 (0.68) DRD2SIGMAR1CHRM4MEN1KMT2A
SCHEMBL6044182 0.85 SIGMAR1 (0.56) DRD2SIGMAR1CHRM4MEN1KMT2A
SCHEMBL6360566 0.85 SIGMAR1 (0.63) DRD2SIGMAR1CHRM4MEN1KMT2A
SCHEMBL28069271 0.83 DRD2 (0.64) DRD2SIGMAR1CHRM4MEN1KMT2A
SCHEMBL16462936 0.83 CNR2 (0.67) DRD2SIGMAR1
SCHEMBL6023725 0.81 MEN1 (0.68) DRD2SIGMAR1MEN1KMT2AACHE
SCHEMBL22755777 0.81 MEN1 (0.68) DRD2SIGMAR1MEN1KMT2AACHE
SCHEMBL3598146 0.81 MEN1 (0.68) DRD2SIGMAR1MEN1KMT2AACHE

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
CN-109956931-B Tetrahydropyrrole compound, preparation method thereof, pharmaceutical composition and application thereof 迈第康(上海)生物医药科技有限公司 2021-07-16 CN disclosed
US-20210024498-A1 TETRAHYDROPYRROLE COMPOUND, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION CONTAINING SAME, AND USE THEREOF MEDICONNS SHANGHAI BIOPHARMACEUTICAL CO LTD (CN) 2021-01-28 US disclosed
US-20210024498-A1 TETRAHYDROPYRROLE COMPOUND, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION CONTAINING SAME, AND USE THEREOF MEDICONNS SHANGHAI BIOPHARMACEUTICAL CO LTD (CN) 2021-01-28 US disclosed
CN-111978295-A Preparation method of tetrahydropyrrole compound 迈第康(上海)生物医药科技有限公司 2020-11-24 CN disclosed
EP-3733670-A1 TETRAHYDROPYRROLE COMPOUND, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION CONTAINING SAME, AND USE THEREOF Mediconns (Shanghai) Biopharmaceutical Co., Ltd (CN) 2020-11-04 EP disclosed
EP-3733670-A1 TETRAHYDROPYRROLE COMPOUND, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION CONTAINING SAME, AND USE THEREOF Mediconns (Shanghai) Biopharmaceutical Co., Ltd (CN) 2020-11-04 EP disclosed
CN-109956931-A Tetrahydropyrrole compound, preparation method, pharmaceutical composition and purposes 迈第康(上海)生物医药科技有限公司 2019-07-02 CN disclosed
US-20050176727-A1 Oximes and hydrazones that are useful in treating sexual dysfunction ABBOTT LABORATORIES 2005-08-11 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-20210024498-A1 TETRAHYDROPYRROLE COMPOUND, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION CONTAINING SAME, AND USE THEREOF PRLHR, DRD2, AVPR2 DRD2 2/4885SIGMAR1 161/4885CHRM4 604/4885
US-20050176727-A1 Oximes and hydrazones that are useful in treating sexual dysfunction CYP19A1, SHBG, CYP17A1 DRD2 1704/4885SIGMAR1 1275/4885CHRM4 640/4885

“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.