SCHEMBL30769237

SCHEMBL30769237

COC(OC)C1CCN(c2ccc(Br)c(C)c2)CC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.39
RAD52 P43351 1/20 0.39
TSHR P16473 1/20 0.39
ADRB1 P08588 1/20 0.37
HTR1D P28221 1/20 0.37
HTR1B P28222 1/20 0.37
HTR2A P28223 1/20 0.37
POLB P06746 1/20 0.36
MAPT P10636 3/20 0.36
LMNA P02545 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
CHRNA3 P32297 1/20 0.35
LGMN Q99538 1/20 0.34
TP53 P04637 1/20 0.34
ALDH1A1 P00352 2/20 0.34
HPGD P15428 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
SUV39H2 Q9H5I1 4/20 0.34
RXRA P19793 1/20 0.33

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
SCHEMBL30768476 0.84 MAPT (0.42) MAPTLMNAMEN1KMT2AALDH1A1
SCHEMBL29683460 0.84 DPP4 (0.36) MAPTLMNAMEN1KMT2ALGMN
SCHEMBL20211889 0.84 DPP4 (0.36) MAPTLMNAMEN1KMT2ALGMN
SCHEMBL24847849 0.81 DPP4 (0.38) TSHRMAPTLMNAMEN1KMT2A
SCHEMBL20231014 0.80 IGF1R (0.42) ADRB1MAPTLMNAMEN1KMT2A
SCHEMBL29927711 0.78 ALDH1A1 (0.47) POLBMAPTLMNAMEN1KMT2A
SCHEMBL25134014 0.78 ALDH1A1 (0.47) POLBMAPTLMNAMEN1KMT2A
SCHEMBL30643679 0.78 NPY5R (0.41) ADRB1MAPTMEN1KMT2AALDH1A1
SCHEMBL26641199 0.78 NPY5R (0.41) ADRB1MAPTMEN1KMT2AALDH1A1
SCHEMBL24319603 0.76 SIRT6 (0.41) MAPTLMNAMEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4543871-A1 ESTROGEN RECEPTOR ALPHA DEGRADERS AND USE THEREOF Relay Therapeutics, Inc. (US) 2025-04-30 EP disclosed
WO-2024169871-A1 BTK INHIBITOR AND USE THEREOF 江苏威凯尔医药科技有限公司 2024-08-22 WO disclosed
CN-118515673-A BTK inhibitor and application thereof 江苏威凯尔医药科技有限公司 2024-08-20 CN disclosed
WO-2024006781-A1 ESTROGEN RECEPTOR ALPHA DEGRADERS AND USE THEREOF RELAY THERAPEUTICS, INC. (US) 2024-01-04 WO disclosed