SCHEMBL31020064

SCHEMBL31020064

CS(=O)(=O)C1NCCc2ccccc21

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PRCP P42785 8/20 0.53
TSHR P16473 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
GAA P10253 2/20 0.49
HTR2A P28223 1/20 0.49
HTR2C P28335 1/20 0.49
HTR2B P41595 1/20 0.49
ALDH1A1 P00352 2/20 0.47
KDM4E B2RXH2 1/20 0.47
GID4 Q8IVV7 1/20 0.45
SLC22A1 O15245 1/20 0.45
RECQL P46063 1/20 0.45
MAPT P10636 2/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL15355400 1.00 PRCP (0.53) PRCPTSHRNPSR1GAAHTR2A
SCHEMBL15355308 0.83 PRCP (0.50) PRCPTSHRNPSR1GAAHTR2A
SCHEMBL11498386 0.83 PRCP (0.50) PRCPTSHRNPSR1GAAHTR2A
SCHEMBL11178190 0.83 PRCP (0.50) PRCPTSHRNPSR1GAAHTR2A
SCHEMBL1243001 0.83 PRCP (0.50) PRCPTSHRNPSR1GAAHTR2A
SCHEMBL30804802 0.82 ALDH1A1 (0.38) PRCPTSHRHTR2AHTR2CHTR2B
Hydrochloric Acid SCHEMBL28063035 0.81 TSHR (0.55) PRCPTSHRNPSR1GAAHTR2A
Hydrochloric Acid SCHEMBL8081587 0.81 GAA (0.51) PRCPTSHRNPSR1GAAHTR2A
SCHEMBL4554907 0.78 DRD2 (0.46) TSHRALDH1A1KDM4E
SCHEMBL13733781 0.78 CA1 (0.40) TSHRHTR2AHTR2CHTR2BKDM4E

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-119948023-A Regulator containing piperidine polycyclic derivative, preparation method and application thereof 上海翰森生物医药科技有限公司 2025-05-06 CN disclosed
CN-118451079-A Benzopiperidine derivative modulators, methods of preparation and uses thereof 上海翰森生物医药科技有限公司 2024-08-06 CN disclosed