SCHEMBL4190882

SCHEMBL4190882

CC(CC1CCCCC1)NCc1ccccc1N/C(N)=N/S(C)(=O)=O

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CTSD P07339 8/20 0.39
F2RL1 P55085 1/20 0.37
GRIN2D O15399 2/20 0.37
GRIN3B O60391 2/20 0.37
GRIN1 Q05586 2/20 0.37
GRIN2A Q12879 2/20 0.37
GRIN2B Q13224 2/20 0.37
GRIN2C Q14957 2/20 0.37
GRIN3A Q8TCU5 2/20 0.37
SIGMAR1 Q99720 2/20 0.37
KMT2A Q03164 1/20 0.36
NOS3 P29474 1/20 0.35
NOS1 P29475 1/20 0.35
NOS2 P35228 1/20 0.35
KDM4E B2RXH2 2/20 0.34
PKM P14618 1/20 0.34
NPY5R Q15761 1/20 0.33
USP30 Q70CQ3 1/20 0.33

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
SCHEMBL4190888 1.00 CTSD (0.39) CTSDF2RL1GRIN2DGRIN3BGRIN1
SCHEMBL4192581 0.87 KDM4E (0.43) CTSDGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL4192576 0.87 KDM4E (0.43) CTSDGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL4203657 0.86 LMNA (0.38) CTSDKDM4EPKM
SCHEMBL4203651 0.86 LMNA (0.38) CTSDKDM4EPKM
SCHEMBL4195029 0.85 F2 (0.40) CTSDF2RL1KMT2APKM
SCHEMBL4195026 0.85 F2 (0.40) CTSDF2RL1KMT2APKM
SCHEMBL4195568 0.82 METAP2 (0.40) CTSDF2RL1GRIN2DGRIN3BGRIN1
SCHEMBL4192548 0.80 KMT2A (0.47) F2RL1KMT2AKDM4ENPY5R
SCHEMBL4186462 0.79 KDM4E (0.43) CTSDF2RL1KMT2AKDM4EPKM

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-20090215764-A1 Antimicrobial agents RANBAXY LABORATORIES LIMITED (IN) 2009-08-27 US claimed
US-8076370-B2 Antimicrobial agents RANBAXY LABORATORIES LIMITED (IN) 2011-12-13 US disclosed
US-20090215764-A1 Antimicrobial agents RANBAXY LABORATORIES LIMITED (IN) 2009-08-27 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-20090215764-A1 Antimicrobial agents TUFM, RPS17, HARS1 CTSD 1587/4885F2RL1 4733/4885GRIN2D 4622/4885

“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.