SCHEMBL4473418

SCHEMBL4473418

CC(=O)c1sc(NC(=O)O)nc1C

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 5/20 0.70
GAA P10253 3/20 0.70
CYP1A2 P05177 1/20 0.70
CYP2C9 P11712 1/20 0.70
SMN1; SMN2 Q16637 8/20 0.68
ALDH1A1 P00352 7/20 0.68
RAB9A P51151 10/20 0.62
NPC1 O15118 8/20 0.62
KMT2A Q03164 5/20 0.62
MEN1 O00255 3/20 0.62
MAPT P10636 2/20 0.62
HTT P42858 2/20 0.62
LMNA P02545 1/20 0.62
TSHR P16473 1/20 0.62
L3MBTL1 Q9Y468 1/20 0.62
NPSR1 Q6W5P4 1/20 0.59
KDM4E B2RXH2 3/20 0.57
HPGD P15428 1/20 0.57
PKM P14618 2/20 0.56
TP53 P04637 1/20 0.56

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
SCHEMBL2835357 0.89 RXFP1 (0.70) RXFP1GAACYP1A2CYP2C9SMN1; SMN2
SCHEMBL4393473 0.86 RXFP1 (0.53) RXFP1GAACYP1A2CYP2C9SMN1; SMN2
SCHEMBL4516696 0.85 RXFP1 (0.66) RXFP1GAACYP1A2CYP2C9SMN1; SMN2
SCHEMBL1592594 0.82 RXFP1 (0.62) RXFP1GAACYP1A2CYP2C9SMN1; SMN2
SCHEMBL1911610 0.82 RXFP1 (0.62) RXFP1GAACYP1A2CYP2C9SMN1; SMN2
SCHEMBL3604834 0.82 RXFP1 (0.62) RXFP1GAACYP1A2CYP2C9SMN1; SMN2
SCHEMBL28508629 0.82 ALDH1A1 (0.77) RXFP1GAACYP1A2CYP2C9SMN1; SMN2
SCHEMBL2559879 0.82 ALDH1A1 (0.76) RXFP1GAACYP1A2CYP2C9SMN1; SMN2
SCHEMBL364881 0.81 RXFP1 (0.49) RXFP1GAACYP1A2CYP2C9SMN1; SMN2
SCHEMBL7923956 0.81 ALDH1A1 (0.70) RXFP1GAACYP1A2CYP2C9SMN1; 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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7550486-B2 N-ureidoalkyl-piperidines as modulators of chemokine receptor activity BRISTOL-MYERS SQUIBB COMPANY (US) 2009-06-23 US disclosed
CN-101296911-A Arylurea derivatives as modulators of chemokine receptor activity NOVARTIS AG (CH) 2008-10-29 CN disclosed
US-20080132523-A1 N-UREIDOALKYL-PIPERIDINES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY BRISTOL-MYERS SQUIBB COMPANY 2008-06-05 US disclosed
US-7351720-B2 N-ureidoalkyl-piperidines as modulators of chemokine receptor activity BRISTOL-MYERS SQUIBB COMPANY (US) 2008-04-01 US disclosed
EP-1631286-A4 N-UREIDOALKYL-PIPERIDINES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY BRISTOL MYERS SQUIBB CO (US) 2007-08-29 EP disclosed
EP-1631286-A2 N-UREIDOALKYL-PIPERIDINES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY Bristol-Myers Squibb Company (US) 2006-03-08 EP disclosed
WO-2004110993-A2 N-UREIDOALKYL-PIPERIDINES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY BRISTOL-MYERS SQUIBB COMPANY (US) 2004-12-23 WO disclosed
US-20040259914-A1 N-ureidoalkyl-piperidines as modulators of chemokine receptor activity BRISTOL-MYERS SQUIBB COMPANY 2004-12-23 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 (2 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-20080132523-A1 N-UREIDOALKYL-PIPERIDINES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY ACKR3, CCR7, CCR2 RXFP1 184/4885GAA 3643/4885CYP1A2 3241/4885
US-20040259914-A1 N-ureidoalkyl-piperidines as modulators of chemokine receptor activity ACKR3, CCR1, CXCR1 RXFP1 124/4885GAA 3829/4885CYP1A2 3199/4885

“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.