SCHEMBL5482928

SCHEMBL5482928

C[C@H](Cc1c[nH]c2c(OCc3ccccc3)cccc12)NC(=O)O

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ADRB3 P13945 14/20 0.60
LTA4H P09960 1/20 0.58
PLA2G2A P14555 1/20 0.58
TRPM8 Q7Z2W7 1/20 0.58
ADRB2 P07550 7/20 0.53
ADRB1 P08588 6/20 0.51
ECE1 P42892 1/20 0.43
KDM4E B2RXH2 2/20 0.43
ALDH1A1 P00352 1/20 0.43
MAPK1 P28482 1/20 0.43
MTNR1A P48039 1/20 0.42
MTNR1B P49286 1/20 0.42
TDP1 Q9NUW8 1/20 0.42

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
SCHEMBL5645892 0.88 ADRB3 (0.55) ADRB3LTA4HPLA2G2ATRPM8ADRB2
SCHEMBL7570378 0.88 ADRB3 (0.55) ADRB3LTA4HPLA2G2ATRPM8ADRB2
Oxalic Acid SCHEMBL7571181 0.85 LTA4H (0.62) ADRB3LTA4HPLA2G2ATRPM8ADRB2
SCHEMBL5476693 0.81 ADRB3 (0.55) ADRB3LTA4HPLA2G2ATRPM8ADRB2
SCHEMBL5481516 0.81 LTA4H (0.69) ADRB3LTA4HPLA2G2ATRPM8ADRB2
SCHEMBL5648360 0.81 LTA4H (0.69) ADRB3LTA4HPLA2G2ATRPM8ADRB2
SCHEMBL5485060 0.81 ADRB3 (0.54) ADRB3ADRB2ADRB1KDM4EALDH1A1
SCHEMBL5479233 0.81 ADRB3 (0.54) ADRB3ADRB2ADRB1KDM4EALDH1A1
SCHEMBL837541 0.81 LTA4H (0.65) ADRB3LTA4HPLA2G2ATRPM8ADRB2
SCHEMBL837542 0.81 LTA4H (0.65) ADRB3LTA4HPLA2G2ATRPM8ADRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7217724-B2 Indole, indazole, and benzazole derivative DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2007-05-15 US disclosed
US-20060063762-A1 Indole indazole and benzazole derivative DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2006-03-23 US disclosed
EP-1514869-A1 INDOLE, INDAZOLE, AND BENZAZOLE DERIVATIVE SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2005-03-16 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-20060063762-A1 Indole indazole and benzazole derivative ADRB3, ADRA2C, ADRB2 ADRB3 1/4885LTA4H 3017/4885PLA2G2A 3711/4885

“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.