SCHEMBL8746922

SCHEMBL8746922

CC1CNCCC1CC(=O)O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A11 P48066 6/20 0.55
SLC6A13 Q9NSD5 6/20 0.55
SLC6A12 P48065 5/20 0.55
SLC6A1 P30531 4/20 0.55
GABRA5 P31644 3/20 0.55
GABRB2 P47870 3/20 0.55
GABRA1 P14867 2/20 0.55
GABRA4 P48169 2/20 0.55
GABRR1 P24046 1/20 0.55
SMYD3 Q9H7B4 2/20 0.36
CHRM1 P11229 2/20 0.36
CHRM3 P20309 2/20 0.36
CHRM2 P08172 1/20 0.36
CHRM4 P08173 1/20 0.36
TSHR P16473 2/20 0.34
GABRP O00591 1/20 0.34
GABRD O14764 1/20 0.34
GABRB1 P18505 1/20 0.34
GABRG2 P18507 1/20 0.34
GABRB3 P28472 1/20 0.34

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
Hydrochloric Acid SCHEMBL18299954 0.98 SLC6A11 (0.53) SLC6A11SLC6A13SLC6A12SLC6A1GABRA5
SCHEMBL19815606 0.85 SLC6A11 (0.55) SLC6A11SLC6A13SLC6A12SLC6A1GABRA5
Hydrochloric Acid SCHEMBL28784255 0.83 SLC6A11 (0.53) SLC6A11SLC6A13SLC6A12SLC6A1GABRA5
SCHEMBL13483847 0.83 SLC6A1 (0.40) SLC6A11SLC6A13SLC6A12SLC6A1GABRA5
SCHEMBL13483848 0.80 SLC6A1 (0.38) SLC6A11SLC6A13SLC6A12SLC6A1GABRA5
SCHEMBL13483849 0.80 SLC6A1 (0.38) SLC6A11SLC6A13SLC6A12SLC6A1GABRA5
SCHEMBL18307342 0.80 SLC6A1 (0.38) SLC6A11SLC6A13SLC6A12SLC6A1GABRA5
SCHEMBL11050032 0.79 SLC6A11 (0.53) SLC6A11SLC6A13SLC6A12SLC6A1GABRA5
Hydrochloric Acid SCHEMBL18299415 0.79 SLC6A1 (0.37) SLC6A11SLC6A13SLC6A12SLC6A1GABRA5
SCHEMBL1249676 0.78 SLC6A11 (0.57) SLC6A11SLC6A13SLC6A12SLC6A1GABRA5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230066771-A1 NUCLEAR RECEPTOR MODULATORS ABBVIE INC (US) 2023-03-02 US disclosed
US-20210130293-A1 NUCLEAR RECEPTOR MODULATORS ABBVIE INC (US) 2021-05-06 US disclosed
CN-107820494-B Nuclear receptor modulators 艾伯维公司 2020-10-16 CN disclosed
EP-3636643-A1 NUCLEAR RECEPTOR MODULATORS (ROR) FOR THE TREATMENT OF INFLAMMATORY AND AUTOIMMUNE DISEASES AbbVie Inc. (US) 2020-04-15 EP disclosed
US-20190055196-A1 NUCLEAR RECEPTOR MODULATORS ABBVIE INC (US) 2019-02-21 US disclosed
WO-2018021977-A1 GLYCINE METABOLISM MODULATORS AND USES THEREOF AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2018-02-01 WO disclosed
WO-2016200851-A1 NUCLEAR RECEPTOR MODULATORS ABBVIE INC. (US) 2016-12-15 WO disclosed
US-20160362370-A1 NUCLEAR RECEPTOR MODULATORS ABBVIE INC. (US) 2016-12-15 US disclosed
US-20160362370-A1 NUCLEAR RECEPTOR MODULATORS ABBVIE INC. (US) 2016-12-15 US disclosed
WO-2016198908-A1 ROR NUCLEAR RECEPTOR MODULATORS ABBVIE INC. (US) 2016-12-15 WO disclosed
EP-0751937-A1 N-(BENZHYDRYLOXYALKYL)-4-(CARBOXY/CARBAMOYL-METHYL)-PIPERIDINE DERIVATIVES AS ANTIDEPRESSANTS COOPERATION PHARMACEUTIQUE FRANCAISE (FR) 1997-01-08 EP disclosed
WO-1995026336-A1 N-(BENZHYDRYLOXYALKYL)-4-(CARBOXY/CARBAMOYL-METHYL)-PIPERIDINE DERIVATIVES AS ANTIDEPRESSANTS COOPERATION PHARMACEUTIQUE FRANCAISE (FR) 1995-10-05 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-20160362370-A1 NUCLEAR RECEPTOR MODULATORS NR1I2, NR1H2, NR5A2 SLC6A11 2278/4885SLC6A13 3458/4885SLC6A12 4492/4885
US-20210130293-A1 NUCLEAR RECEPTOR MODULATORS NR1I2, NR1H2, NR5A2 SLC6A11 2278/4885SLC6A13 3458/4885SLC6A12 4492/4885
US-20230066771-A1 NUCLEAR RECEPTOR MODULATORS NR1I2, NR1H2, NR5A2 SLC6A11 2278/4885SLC6A13 3458/4885SLC6A12 4492/4885
US-20190055196-A1 NUCLEAR RECEPTOR MODULATORS NR1I2, NR1H2, NR5A2 SLC6A11 2278/4885SLC6A13 3458/4885SLC6A12 4492/4885

“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.