SCHEMBL30200837

SCHEMBL30200837

Cc1c(I)cnn1CC(C)C

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 3/20 0.33
HTR2C P28335 3/20 0.33
HTR2B P41595 2/20 0.33
TOP2A P11388 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
PDE9A O76083 1/20 0.32
GRM2 Q14416 1/20 0.30
ACHE P22303 1/20 0.30
P2RX3 P56373 1/20 0.30
P2RX2 Q9UBL9 1/20 0.30

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
SCHEMBL6156321 0.79 POLB (0.38) HTR2AHTR2CHTR2BTOP2ASMN1; SMN2
SCHEMBL1359083 0.78 MAP2K1 (0.35) HTR2AHTR2CHTR2BSMN1; SMN2
SCHEMBL19504916 0.77
SCHEMBL23400623 0.76 HTR2A (0.41) HTR2AHTR2CHTR2BTOP2ASMN1; SMN2
SCHEMBL6154539 0.76 HTR2A (0.34) HTR2AHTR2CHTR2BTOP2ASMN1; SMN2
SCHEMBL21502008 0.74 TOP2A (0.34) HTR2AHTR2CHTR2BTOP2ASMN1; SMN2
SCHEMBL6156758 0.71 KDM4E (0.41) SMN1; SMN2ACHE
SCHEMBL6155240 0.71 MAPK1 (0.45) SMN1; SMN2ACHE
SCHEMBL20197167 0.69 GRM2 (0.34) HTR2AHTR2CHTR2BGRM2
SCHEMBL691749 0.69 TSHR (0.53) HTR2AHTR2CHTR2BTOP2ASMN1; SMN2

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
EP-4401729-A1 BCL-XL DEGRADERS AND USES THEREOF Kymera Therapeutics, Inc. (US) 2024-07-24 EP disclosed
WO-2023044046-A1 BCL-XL DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2023-03-23 WO disclosed