SCHEMBL5869445

SCHEMBL5869445

CCOC(=O)C(Cc1ccc(-c2ccc(F)cc2)cc1)NC(CC(C)C)C(=O)OCc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GPR34 Q9UPC5 1/20 0.47
CTSK P43235 4/20 0.46
CTSL P07711 2/20 0.46
CA12 O43570 1/20 0.45
CA7 P43166 1/20 0.45
CA9 Q16790 1/20 0.45
CA14 Q9ULX7 1/20 0.45
MGLL Q99685 1/20 0.45
MME P08473 2/20 0.45
PPARG P37231 1/20 0.44
PPARA Q07869 1/20 0.44
HSD17B10 Q99714 1/20 0.44
TACR1 P25103 1/20 0.43
ACE P12821 1/20 0.43
CPA1 P15085 1/20 0.43
ACE2 Q9BYF1 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
SCHEMBL5869439 1.00 GPR34 (0.47) GPR34CTSKCTSLCA12CA7
SCHEMBL5869436 1.00 GPR34 (0.47) GPR34CTSKCTSLCA12CA7
SCHEMBL5869701 0.92 CTSK (0.52) CTSKCTSLMMEHSD17B10TACR1
SCHEMBL5869693 0.92 CTSK (0.52) CTSKCTSLMMEHSD17B10TACR1
SCHEMBL5869698 0.92 CTSK (0.52) CTSKCTSLMMEHSD17B10TACR1
SCHEMBL5870522 0.89 AAK1 (0.46) CTSKCTSLMMEHSD17B10TACR1
SCHEMBL5870515 0.89 AAK1 (0.46) CTSKCTSLMMEHSD17B10TACR1
SCHEMBL5870517 0.89 AAK1 (0.46) CTSKCTSLMMEHSD17B10TACR1
SCHEMBL5870079 0.88 CTSK (0.48) CTSKCTSLHSD17B10TACR1
SCHEMBL5870077 0.88 CTSK (0.48) CTSKCTSLHSD17B10TACR1

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-7045532-B2 ACE-2 modulating compounds and methods of use thereof MILLENNIUM PHARMACEUTICALS, INC. (US) 2006-05-16 US disclosed
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 GPR34 553/4885CTSK 541/4885CTSL 911/4885

“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.