SCHEMBL5328178

SCHEMBL5328178

CCOC(=O)C1=C(C)NC2=C(C(=O)CC(c3ccc(OC)c(OC)c3)C2)C1c1ccc(C)o1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 11/20 1.00
USP2 O75604 4/20 1.00
MAPK1 P28482 2/20 1.00
RAB9A P51151 1/20 1.00
TSHR P16473 2/20 0.59
MAPT P10636 4/20 0.57
TDP1 Q9NUW8 2/20 0.57
KDM4E B2RXH2 9/20 0.53
LMNA P02545 4/20 0.52
GAA P10253 3/20 0.52
KMT2A Q03164 2/20 0.52
HSD17B10 Q99714 4/20 0.51
NPSR1 Q6W5P4 3/20 0.51
TP53 P04637 3/20 0.51
POLB P06746 2/20 0.51
SMN1; SMN2 Q16637 5/20 0.50
AGTR1 P30556 1/20 0.50
MEN1 O00255 1/20 0.50
HPGD P15428 2/20 0.49
CASP1 P29466 1/20 0.47

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
SCHEMBL5333982 0.94 ALDH1A1 (0.89) ALDH1A1USP2MAPK1RAB9ATSHR
SCHEMBL5387295 0.94 ALDH1A1 (0.88) ALDH1A1USP2MAPK1RAB9ATSHR
SCHEMBL5333016 0.93 ALDH1A1 (0.88) ALDH1A1USP2MAPK1RAB9ATSHR
SCHEMBL5472516 0.93 ALDH1A1 (0.86) ALDH1A1USP2MAPK1RAB9ATSHR
SCHEMBL5329955 0.92 ALDH1A1 (0.85) ALDH1A1USP2MAPK1RAB9ATSHR
SCHEMBL5338225 0.91 ALDH1A1 (0.84) ALDH1A1USP2MAPK1RAB9ATSHR
SCHEMBL5332496 0.91 ALDH1A1 (0.83) ALDH1A1USP2MAPK1RAB9ATSHR
SCHEMBL5337219 0.90 ALDH1A1 (0.81) ALDH1A1USP2MAPK1RAB9ATSHR
SCHEMBL5330171 0.90 ALDH1A1 (0.81) ALDH1A1USP2MAPK1RAB9ATSHR
SCHEMBL5478292 0.89 ALDH1A1 (0.80) ALDH1A1USP2MAPK1RAB9ATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070112015-A1 Substituted dihydropyridines and methods of use CHEMOCENTRYX, INC. (US) 2007-05-17 US disclosed
WO-2007051062-A2 SUBSTITUTED DIHYDROPYRIDINES AND METHODS OF USE CHEMOCENTRYX, INC. (US) 2007-05-03 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-20070112015-A1 Substituted dihydropyridines and methods of use C3AR1, C5AR1, C5AR2 ALDH1A1 1488/4885USP2 4362/4885MAPK1 4425/4885

“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.