SCHEMBL8437201

SCHEMBL8437201

CCCCOC(=O)C(CC(C)C)N[C@@H](Cc1ccc(O)cc1)C(=O)OC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IL1RN P18510 6/20 0.50
ERAP2 Q6P179 6/20 0.50
ERAP1 Q9NZ08 5/20 0.50
FOLH1 Q04609 1/20 0.48
TAS1R3 Q7RTX0 2/20 0.46
TAS1R1 Q7RTX1 2/20 0.46
TSHR P16473 2/20 0.45
NPY4R P50391 2/20 0.44
NPY1R P25929 1/20 0.44
CNR1 P21554 1/20 0.44
CNR2 P34972 1/20 0.44
ESR1 P03372 2/20 0.44
ESR2 Q92731 1/20 0.44
ANPEP P15144 1/20 0.43
KMT2A Q03164 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
LMNA P02545 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2D6 P10635 1/20 0.43
MAPK1 P28482 1/20 0.43

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
SCHEMBL8440620 0.93 FOLH1 (0.48) IL1RNERAP2ERAP1FOLH1TAS1R3
SCHEMBL8248870 0.82 ANPEP (0.55) IL1RNERAP2ERAP1FOLH1TSHR
SCHEMBL8008631 0.82 NPSR1 (0.53) IL1RNERAP2ERAP1TSHRCNR1
SCHEMBL6826832 0.82 NPSR1 (0.53) IL1RNERAP2ERAP1TSHRCNR1
SCHEMBL1721283 0.82 NPSR1 (0.53) IL1RNERAP2ERAP1TSHRCNR1
SCHEMBL8436685 0.80 HPGD (0.42) IL1RNERAP2ERAP1FOLH1LMNA
SCHEMBL8437490 0.80 TAS1R3 (0.42) TAS1R3TAS1R1ANPEPNPSR1SMN1; SMN2
SCHEMBL9848012 0.78 ESR1 (0.48) IL1RNERAP2ERAP1TSHRCNR1
SCHEMBL3055258 0.78 TACR1 (0.50) TSHRCNR1CNR2ESR1ESR2
SCHEMBL3055256 0.78 TACR1 (0.50) TSHRCNR1CNR2ESR1ESR2

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-20040082496-A1 ACE-2 modulating compounds and methods of use thereof MILLENNIUM PHARMACEUTICALS, INC. 2004-04-29 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-20040082496-A1 ACE-2 modulating compounds and methods of use thereof ACE, ACE2, AGTR2 IL1RN 1603/4885ERAP2 33/4885ERAP1 259/4885

“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.