SCHEMBL14566176

SCHEMBL14566176

CCCC1(CCC)CCN(c2ccc(Cl)c(OC)c2)C1=O

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 10/20 0.45
HTR2A P28223 6/20 0.45
HTR2B P41595 5/20 0.45
MALT1 Q9UDY8 1/20 0.41
DOCK5 Q9H7D0 1/20 0.40
ADAMTS5 Q9UNA0 2/20 0.38
CCR1 P32246 2/20 0.37
TSHR P16473 1/20 0.37
MCOLN3 Q8TDD5 1/20 0.37
MCHR1 Q99705 2/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37

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
SCHEMBL14566263 0.83 HTR2C (0.36) HTR2CHTR2AHTR2BMALT1DOCK5
SCHEMBL12574815 0.73 EGLN1 (0.46)
SCHEMBL11819635 0.72 ATM (0.46) HTR2CHTR2AHTR2BCCR1TSHR
SCHEMBL20813839 0.70 HRH3 (0.46)
SCHEMBL4814583 0.70 USP30 (0.55) MALT1DOCK5
SCHEMBL5827625 0.68 MCHR1 (0.47) HTR2CHTR2AHTR2BTSHRMCOLN3
SCHEMBL20813850 0.67 LIPE (0.53)
SCHEMBL20814118 0.67 LIPE (0.53)
SCHEMBL3228974 0.66 MAPT (0.49) CCR1TSHRMCOLN3LMNAMAPT
SCHEMBL20814122 0.66 LIPE (0.48)

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-2007027734-A2 BICYCLIC AND BRIDGED NITROGEN HETEROCYCLES CHEMOCENTRYX, INC. (US) 2007-03-08 WO disclosed