Pyrrolidine

Pyrrolidine

SCHEMBL28534606

C1CCNC1.O=C(O)CBr

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.56
ALDH1A1 P00352 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.35
CXCR4 P61073 1/20 0.35
GABRA5 P31644 3/20 0.35
GABRB2 P47870 3/20 0.35
GABRA1 P14867 2/20 0.35
GABRA4 P48169 2/20 0.35
GABRP O00591 1/20 0.35
GABRD O14764 1/20 0.35
GABRB1 P18505 1/20 0.35
GABRG2 P18507 1/20 0.35
GABRB3 P28472 1/20 0.35
GABRA3 P34903 1/20 0.35
GABRA2 P47869 1/20 0.35
GABRE P78334 1/20 0.35
PMP22 Q01453 1/20 0.35
GABRA6 Q16445 1/20 0.35
GABRG1 Q8N1C3 1/20 0.35
GABRG3 Q99928 1/20 0.35

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
Piperidine SCHEMBL27321260 0.97 TSHR (0.53) TSHRALDH1A1SMN1; SMN2CXCR4GABRA5
Pyrrolidine SCHEMBL8989886 0.81 ALDH1A1 (0.40) TSHRALDH1A1SMN1; SMN2CXCR4PMP22
Pyrrolidine SCHEMBL31336952 0.80 ALDH1A1 (0.44) TSHRALDH1A1SMN1; SMN2CXCR4GABRA5
Pyrrolidine SCHEMBL712847 0.78
Pyrrolidine SCHEMBL10413119 0.78 FFAR3 (0.56) TSHRALDH1A1SMN1; SMN2CXCR4GABRA5
Succinic Acid SCHEMBL5874145 0.78 LMNA (0.50) TSHRALDH1A1SMN1; SMN2CXCR4PMP22
Piperidine SCHEMBL1274941 0.78 FFAR3 (0.56) TSHRALDH1A1SMN1; SMN2CXCR4GABRA5
Piperidine SCHEMBL11192905 0.78 ALDH1A1 (0.50) TSHRALDH1A1SMN1; SMN2CXCR4GABRA5
Succinic Acid SCHEMBL5874137 0.78 LMNA (0.50) TSHRALDH1A1SMN1; SMN2CXCR4PMP22
Piperidine SCHEMBL6861563 0.78 FFAR3 (0.56) TSHRALDH1A1SMN1; SMN2CXCR4GABRA5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112533607-B TLR7 agonists 普利缪尼治疗学股份有限公司 2025-01-07 CN disclosed
CN-112533607-A TLR7 agonists 普利缪尼治疗学股份有限公司 2021-03-19 CN disclosed