SCHEMBL4725110

SCHEMBL4725110

CN(C)CCN(C)Cc1csc(NC(=O)NCc2ccc3c(c2)OCO3)n1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 11/20 0.49
MEN1 O00255 7/20 0.49
RAB9A P51151 2/20 0.49
KDM4E B2RXH2 4/20 0.47
PPARG P37231 1/20 0.47
NCOA2 Q15596 1/20 0.47
NCOA1 Q15788 1/20 0.47
NCOA3 Q9Y6Q9 1/20 0.47
NPC1 O15118 1/20 0.47
POLB P06746 1/20 0.47
TSHR P16473 2/20 0.45
HPGD P15428 1/20 0.45

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
SCHEMBL4796719 0.90 KMT2A (0.49) KMT2AMEN1RAB9AKDM4EPPARG
SCHEMBL4725095 0.86 KMT2A (0.50) KMT2AMEN1RAB9AKDM4EPPARG
SCHEMBL4777144 0.83 ROCK1 (0.43) KMT2AMEN1TSHR
SCHEMBL4779190 0.83 KMT2A (0.56) KMT2AMEN1RAB9AKDM4EPPARG
Hydrochloric Acid SCHEMBL4956924 0.82 ROCK1 (0.42) KMT2AMEN1TSHR
SCHEMBL354558 0.80 GAA (0.46) KMT2AMEN1RAB9AKDM4EPPARG
SCHEMBL354409 0.79 HPGD (0.46) KMT2AMEN1NPC1TSHRHPGD
SCHEMBL4794995 0.78 KMT2A (0.52) KMT2AMEN1RAB9AKDM4EPPARG
SCHEMBL4779120 0.78 TRPV1 (0.42) TSHR
Hydrochloric Acid SCHEMBL4958994 0.77 TRPV1 (0.41) TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8716320-B2 Antibacteriall heterocyclic ureas REPLIDYNE, INC. (US) 2014-05-06 US claimed
US-20080207703-A1 Antibacterial heterocyclic ureas REPLIDYNE, INC. (US) 2008-08-28 US claimed
WO-2008011191-A1 ANTIBACTERIAL HETEROCYCLIC UREAS REPLIDYNE, INC. (US) 2008-01-24 WO claimed
US-8716320-B2 Antibacteriall heterocyclic ureas REPLIDYNE, INC. (US) 2014-05-06 US disclosed
US-20080207703-A1 Antibacterial heterocyclic ureas REPLIDYNE, INC. (US) 2008-08-28 US disclosed
WO-2008011191-A1 ANTIBACTERIAL HETEROCYCLIC UREAS REPLIDYNE, INC. (US) 2008-01-24 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-20080207703-A1 Antibacterial heterocyclic ureas UMPS, UROD, UGP2 KMT2A 3349/4885MEN1 2838/4885RAB9A 1509/4885

“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.