SCHEMBL2987254

SCHEMBL2987254

CC(=O)OC(C)(C)C(=O)NC1CCC(Cc2ccccc2Cl)(N(C)C)CC1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SSTR4 P31391 8/20 0.41
SSTR1 P30872 4/20 0.41
POLB P06746 2/20 0.35
HPGD P15428 1/20 0.35
SIGMAR1 Q99720 1/20 0.35
ALDH1A1 P00352 3/20 0.35
GAA P10253 1/20 0.35
EPHX2 P34913 1/20 0.35
REN P00797 1/20 0.35
HSD11B1 P28845 1/20 0.35
HSD11B2 P80365 1/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
HTT P42858 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
MEN1 O00255 1/20 0.34
MAPK1 P28482 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL2984736 0.87 HSD11B1 (0.48) SSTR4SSTR1POLBALDH1A1HSD11B1
SCHEMBL2989160 0.85 OPRM1 (0.43) SSTR4SSTR1HPGDALDH1A1GAA
SCHEMBL2987072 0.83 SSTR4 (0.41) SSTR4SSTR1POLBGAAHSD11B1
SCHEMBL2983411 0.82 HSD11B1 (0.42) SSTR4SSTR1HSD11B1HSD11B2
SCHEMBL2989369 0.81 HSD11B1 (0.46) SSTR4SSTR1ALDH1A1HSD11B1HSD11B2
SCHEMBL2982776 0.80 AQP3 (0.39) SSTR4SSTR1POLBHPGDALDH1A1
SCHEMBL2983449 0.79 SSTR4 (0.44) SSTR4SSTR1LMNASMN1; SMN2MEN1
SCHEMBL2985320 0.78 SSTR4 (0.43) SSTR4SIGMAR1ALDH1A1MAPTMEN1
SCHEMBL2985707 0.77 ALDH1A1 (0.44) SSTR4POLBHPGDSIGMAR1ALDH1A1
SCHEMBL2987316 0.76 POLB (0.50) POLBHPGDALDH1A1LMNAMAPT

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-7786328-B2 Cyclohexyl-1,4-diamine compounds GRUENENTHAL GMBH (DE) 2010-08-31 US claimed
US-20070281954-A1 Cyclohexyl-1,4-diamine compounds GRUENENTHAL GMBH (DE) 2007-12-06 US claimed
US-7786328-B2 Cyclohexyl-1,4-diamine compounds GRUENENTHAL GMBH (DE) 2010-08-31 US disclosed
US-20070281954-A1 Cyclohexyl-1,4-diamine compounds GRUENENTHAL GMBH (DE) 2007-12-06 US 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-20070281954-A1 Cyclohexyl-1,4-diamine compounds DPYD, PKD1, AOC1 SSTR4 1326/4885SSTR1 1281/4885POLB 1844/4885

“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.