SCHEMBL4754980

SCHEMBL4754980

CC(C)(C)OC(=O)N1C2=CCCC2C[C@H]1C=O

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.35
CHRM1 P11229 1/20 0.35
CHRM3 P20309 1/20 0.35
GPR119 Q8TDV5 6/20 0.34
KDM4E B2RXH2 2/20 0.34
MAPT P10636 1/20 0.34
THRB P10828 1/20 0.34
NR1H2 P55055 1/20 0.33
JAK2 O60674 1/20 0.33
JAK1 P23458 1/20 0.33
ALDH1A1 P00352 1/20 0.33
DPP4 P27487 1/20 0.32
PREP P48147 1/20 0.32
NAMPT P43490 1/20 0.32
PKM P14618 1/20 0.32

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
SCHEMBL4702140 0.82 NR1H2 (0.39) CHRM2CHRM1CHRM3GPR119KDM4E
SCHEMBL4754148 0.72 ALDH1A1 (0.37) GPR119KDM4EMAPTTHRBJAK2
SCHEMBL14790378 0.71 NR1H2 (0.37) CHRM2CHRM1CHRM3GPR119KDM4E
SCHEMBL20005947 0.68 HTRA1 (0.50) GPR119KDM4ENR1H2JAK2JAK1
SCHEMBL25944417 0.68 CHRM2 (0.50) CHRM2CHRM1CHRM3GPR119KDM4E
SCHEMBL25417641 0.67 NR1H2 (0.47) CHRM2CHRM1CHRM3MAPTNR1H2
SCHEMBL2277430 0.67 NR1H2 (0.44) CHRM2CHRM1CHRM3MAPTNR1H2
SCHEMBL23795442 0.67 DDB1 (0.36) CHRM2CHRM1CHRM3GPR119KDM4E
SCHEMBL30444166 0.67 DDB1 (0.36) CHRM2CHRM1CHRM3GPR119KDM4E
SCHEMBL20005725 0.67 DPP4 (0.40) CHRM2CHRM1CHRM3GPR119KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1909575-A2 SUBSTITUTED N-CINNAMYL BENZAMIDES ChemoCentryx Inc (US) 2008-04-16 EP disclosed
US-20070021484-A1 Substituted N-cinnamyl benzamides CHEMOCENTRYX, INC. (US) 2007-01-25 US disclosed
WO-2007002842-A2 SUBSTITUTED N-CINNAMYL BENZAMIDES CHEMOCENTRYX, INC. (US) 2007-01-04 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070021484-A1 Substituted N-cinnamyl benzamides BRDT, BCCIP, NAT10 CHRM2 4871/4885CHRM1 4881/4885CHRM3 4820/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.