SCHEMBL27360642

SCHEMBL27360642

COCCCN1CC(N)C1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.38
CA4 P22748 1/20 0.38
HRH2 P25021 2/20 0.37
HRH1 P35367 2/20 0.37
GBA1 P04062 1/20 0.37
HRH3 Q9Y5N1 1/20 0.34
GNAI3 P08754 1/20 0.33
GNAO1 P09471 1/20 0.33
GNAI1 P63096 1/20 0.33
GLB1 P16278 1/20 0.32
ALDH1A1 P00352 2/20 0.32
KDM4E B2RXH2 1/20 0.32
GUSB P08236 2/20 0.31
EBP Q15125 1/20 0.31
SIGMAR1 Q99720 1/20 0.31
HTR4 Q13639 2/20 0.30
CYP3A4 P08684 1/20 0.30
BRD4 O60885 1/20 0.30
BRD9 Q9H8M2 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
SCHEMBL11972565 0.86
Hydrochloric Acid SCHEMBL20519453 0.84 GBA1 (0.46) CA2CA4GBA1GNAI3GNAO1
SCHEMBL13543169 0.84 HRH2 (0.52) CA2CA4HRH2HRH1HRH3
SCHEMBL3249860 0.84 HRH2 (0.52) CA2CA4HRH2HRH1HRH3
SCHEMBL8116676 0.79 GNAI3 (0.56) HRH2HRH1HRH3GNAI3GNAO1
SCHEMBL6176615 0.79 GNAI3 (0.56) HRH2HRH1HRH3GNAI3GNAO1
SCHEMBL23023305 0.78 GBA1 (0.37) CA2CA4GBA1HRH3GLB1
SCHEMBL20698402 0.78 GBA1 (0.44) HRH2HRH1GBA1HRH3GLB1
SCHEMBL19174517 0.78 EHMT2 (0.38) CA2CA4GBA1HRH3GLB1
SCHEMBL17284198 0.78 GBA1 (0.34) CA2CA4HRH2HRH1GBA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024039858-A1 ESTROGEN RECEPTOR MODULATORS AND USES THEREOF OLEMA PHARMACEUTICALS, INC. (US) 2024-02-22 WO disclosed