SCHEMBL7986873

SCHEMBL7986873

CCCC(CBr)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 2/20 0.43
SIGMAR1 Q99720 1/20 0.41
LMNA P02545 1/20 0.40
ESR1 P03372 1/20 0.40
ESR2 Q92731 1/20 0.40
HRH1 P35367 6/20 0.38
HTR2A P28223 5/20 0.38
POLB P06746 1/20 0.36
TAAR1 Q96RJ0 2/20 0.35
RIPK1 Q13546 1/20 0.35
CCR5 P51681 1/20 0.35
MAPT P10636 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
SCHEMBL1263573 0.86 AOC3 (0.48) AOC3SIGMAR1LMNAESR1ESR2
SCHEMBL9000717 0.86 SIGMAR1 (0.46) SIGMAR1HTR2A
SCHEMBL30312009 0.85 AOC3 (0.42) AOC3SIGMAR1LMNAESR1ESR2
SCHEMBL17027742 0.84 SIGMAR1 (0.44) SIGMAR1HTR2A
SCHEMBL2419292 0.84 SIGMAR1 (0.44) SIGMAR1HTR2A
SCHEMBL17027773 0.84 SIGMAR1 (0.44) SIGMAR1HTR2A
SCHEMBL9276354 0.84 AOC3 (0.47) AOC3SIGMAR1LMNAESR1ESR2
SCHEMBL7775432 0.82 LMNA (0.48) AOC3SIGMAR1LMNAHRH1HTR2A
SCHEMBL5890038 0.82 LMNA (0.48) AOC3SIGMAR1LMNAHRH1HTR2A
SCHEMBL233438 0.82 LMNA (0.48) AOC3SIGMAR1LMNAESR1ESR2

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
US-6288120-B1 Prevention of loss and restoration of bone mass by certain prostaglandin agonists PFIZER INC. 2001-09-11 US disclosed