SCHEMBL201689

SCHEMBL201689

CCCc1ccc(-c2ccc(C(=O)N[C@@H](Cn3ccnc3)C(=O)O)cc2)cc1

nearest known ligand 0.67

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP26A1 O43174 5/20 0.67
CYP3A4 P08684 4/20 0.50
CYP2C19 P33261 4/20 0.50
CYP2D6 P10635 3/20 0.50
CYP2C9 P11712 3/20 0.50
CYP1A2 P05177 2/20 0.50
CYP19A1 P11511 1/20 0.48
AGTR2 P50052 1/20 0.48
CYP51A1 Q16850 3/20 0.47
TBXAS1 P24557 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
SCHEMBL202436 0.79 CYP26A1 (0.56) CYP26A1CYP3A4CYP2C19CYP2D6CYP2C9
SCHEMBL24240734 0.77 CYP26A1 (0.72) CYP26A1CYP3A4CYP2C19CYP2D6CYP2C9
SCHEMBL202188 0.76 TAS1R3 (0.53) CYP1A2
SCHEMBL9850547 0.75 TBXAS1 (0.49) CYP19A1TBXAS1
SCHEMBL203618 0.74 TAS1R3 (0.51)
SCHEMBL2691599 0.74 HDAC1 (0.53) CYP26A1
SCHEMBL201285 0.73 CA2 (0.60)
SCHEMBL201383 0.73 CA2 (0.52)
SCHEMBL3101929 0.73 ROCK1 (0.67) CYP26A1CYP51A1
SCHEMBL4173638 0.71 TAS1R3 (0.76)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8088804-B2 N-hydroxyamide derivatives possessing antibacterial activity PFIZER INC. (US) 2012-01-03 US disclosed
EP-2338878-A2 N-hydroxyamide derivatives possessing antibacterial activity Vicuron Pharmaceuticals, Inc. (US) 2011-06-29 EP disclosed
US-20100022605-A1 N-HYDROXYAMIDE DERIVATIVES POSSESSING ANTIBACTERIAL ACTIVITY VICURON PHARMACEUTICALS INC. 2010-01-28 US disclosed
EP-1963262-A2 N-HYDROXYAMIDE DERIVATIVES POSSESSING ANTIBACTERIAL ACTIVITY Vicuron Pharmaceuticals, Inc. (US) 2008-09-03 EP disclosed
WO-2007069020-A2 N-HYDROXYAMIDE DERIVATIVES POSSESSING ANTIBACTERIAL ACTIVITY VICURON PHARMACEUTICALS INC. (US) 2007-06-21 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-20100022605-A1 N-HYDROXYAMIDE DERIVATIVES POSSESSING ANTIBACTERIAL ACTIVITY NAAA, HDHD5, HACL2 CYP26A1 1198/4885CYP3A4 1791/4885CYP2C19 1432/4885

“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.