SCHEMBL5334007

SCHEMBL5334007

COc1ccc(C2CC(=O)C3=C(C2)NC(C)=C(C(=O)OCCc2ccccc2)C3c2ccc(C)o2)cc1OC

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.80
USP2 O75604 4/20 0.80
MAPK1 P28482 2/20 0.80
RAB9A P51151 1/20 0.80
SMN1; SMN2 Q16637 5/20 0.55
LMNA P02545 4/20 0.55
TSHR P16473 2/20 0.54
KDM4E B2RXH2 6/20 0.53
HSD17B10 Q99714 5/20 0.53
TP53 P04637 4/20 0.53
NPSR1 Q6W5P4 3/20 0.53
HPGD P15428 3/20 0.53
MAPT P10636 5/20 0.52
TDP1 Q9NUW8 2/20 0.52
GAA P10253 3/20 0.51
KMT2A Q03164 2/20 0.51
MEN1 O00255 1/20 0.49
POLB P06746 1/20 0.48
RXFP1 Q9HBX9 1/20 0.47
PDE1C Q14123 1/20 0.46

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
SCHEMBL5338225 0.93 ALDH1A1 (0.84) ALDH1A1USP2MAPK1RAB9ASMN1; SMN2
SCHEMBL5333016 0.92 ALDH1A1 (0.88) ALDH1A1USP2MAPK1RAB9ASMN1; SMN2
SCHEMBL5333751 0.92 ALDH1A1 (0.79) ALDH1A1USP2MAPK1RAB9ASMN1; SMN2
SCHEMBL5333982 0.90 ALDH1A1 (0.89) ALDH1A1USP2MAPK1RAB9ASMN1; SMN2
SCHEMBL5387295 0.89 ALDH1A1 (0.88) ALDH1A1USP2MAPK1RAB9ASMN1; SMN2
SCHEMBL5328178 0.89 ALDH1A1 (1.00) ALDH1A1USP2MAPK1RAB9ASMN1; SMN2
SCHEMBL5337219 0.89 ALDH1A1 (0.81) ALDH1A1USP2MAPK1RAB9ASMN1; SMN2
SCHEMBL5472516 0.89 ALDH1A1 (0.86) ALDH1A1USP2MAPK1RAB9ASMN1; SMN2
SCHEMBL5340527 0.87 ALDH1A1 (0.60) ALDH1A1USP2MAPK1RAB9ASMN1; SMN2
SCHEMBL5332496 0.87 ALDH1A1 (0.83) ALDH1A1USP2MAPK1RAB9ASMN1; SMN2

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.