SCHEMBL988833

SCHEMBL988833

Cc1cc(C(=O)NCC2CCC(OC=O)CC2)c2c(ccn2Cc2ccc(Cl)cc2)c1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.41
CACNA1I Q9P0X4 1/20 0.41
CCR2 P41597 3/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
P2RX3 P56373 3/20 0.37
PTGER4 P35408 3/20 0.37
PTGDR Q13258 3/20 0.37
HTR4 Q13639 2/20 0.37
CHRM1 P11229 2/20 0.37
ALDH1A1 P00352 1/20 0.37
NAPEPLD Q6IQ20 1/20 0.36
DRD2 P14416 1/20 0.36
DRD4 P21917 1/20 0.36
CNR2 P34972 2/20 0.36
CNR1 P21554 1/20 0.36

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
SCHEMBL987833 0.89 CCR2 (0.47) KCNH2CACNA1ICCR2P2RX3PTGER4
SCHEMBL12584097 0.86 MEN1 (0.45) KCNH2CACNA1ICCR2MEN1KMT2A
SCHEMBL988831 0.85 VCP (0.43) KCNH2CACNA1ICCR2MEN1KMT2A
SCHEMBL987962 0.82 HCRTR1 (0.40) DRD2DRD4
SCHEMBL986580 0.82 DRD2 (0.37) HTR4DRD2DRD4CNR1
SCHEMBL987576 0.81 MCL1 (0.38) KCNH2P2RX3CHRM1ALDH1A1CNR2
SCHEMBL12584136 0.80 PTGER4 (0.43) KCNH2CACNA1ICCR2MEN1KMT2A
SCHEMBL12583944 0.79 MEN1 (0.43) KCNH2CACNA1ICCR2MEN1KMT2A
SCHEMBL988182 0.78 HTR4 (0.35) PTGER4PTGDRHTR4CHRM1ALDH1A1
SCHEMBL12585483 0.78 PTGER4 (0.45) CCR2P2RX3PTGER4PTGDRHTR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8598355-B2 Amide compound ASTELLAS PHARMA INC. (JP) 2013-12-03 US disclosed
EP-2565191-A1 4-(Indol-7-ylcarbonylaminomethyl)cyclohexanecarboxylic acid derivatives as EP4 receptor antagonists useful for the treatment of chronic renal failure or diabetic nephropathy Astellas Pharma Inc. (JP) 2013-03-06 EP disclosed
US-20110144153-A1 AMIDE COMPOUND ASTELLAS PHARMA INC. (JP) 2011-06-16 US disclosed
EP-2277858-A1 AMIDE COMPOUND Astellas Pharma Inc. (JP) 2011-01-26 EP 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-20110144153-A1 AMIDE COMPOUND PTGER4, PTGER1, PTGER2 KCNH2 3210/4885CACNA1I 4404/4885CCR2 385/4885

“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.