SCHEMBL4828138

SCHEMBL4828138

CC(C)OC(=O)N[C@@H](CCN1CCC2(CC1)NC(=O)N(Cc1ccc(Br)cc1)C2=O)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.40
HTT P42858 2/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
KMT2A Q03164 1/20 0.39
CNR1 P21554 1/20 0.38
CCR5 P51681 4/20 0.37
NPSR1 Q6W5P4 1/20 0.36
HDAC6 Q9UBN7 1/20 0.35
UTS2R Q9UKP6 1/20 0.35
PRCP P42785 1/20 0.35
FPR2 P25090 1/20 0.35
CXCR3 P49682 1/20 0.35
ALDH1A1 P00352 3/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
MAPK1 P28482 1/20 0.35

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
Hydrochloric Acid SCHEMBL4830999 0.99 LMNA (0.40) LMNAHTTNPC1RAB9AKMT2A
SCHEMBL4830960 0.93 LMNA (0.44) LMNAHTTNPC1RAB9AKMT2A
Hydrochloric Acid SCHEMBL4830949 0.92 LMNA (0.43) LMNAHTTNPC1RAB9AKMT2A
SCHEMBL4836857 0.91 CCR5 (0.45) LMNAHTTNPC1RAB9AKMT2A
Hydrochloric Acid SCHEMBL4833525 0.90 CCR5 (0.45) LMNAHTTNPC1RAB9AKMT2A
SCHEMBL4834006 0.90 KCNA3 (0.41) LMNAHTTNPC1RAB9AKMT2A
SCHEMBL4827915 0.90 CCR2 (0.44) LMNAHTTNPC1RAB9AKMT2A
SCHEMBL4827825 0.89 LMNA (0.40) LMNAHTTNPC1RAB9AKMT2A
SCHEMBL4836435 0.89 LMNA (0.40) LMNAHTTNPC1RAB9AKMT2A
Hydrochloric Acid SCHEMBL4827872 0.89 KCNA3 (0.41) LMNAHTTNPC1RAB9AKMT2A

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-7351713-B2 Spirohydantoin compounds and methods for the modulation of chemokine receptor activity VIRO CHEM PHARMA, INC. (CA) 2008-04-01 US claimed
US-20050075360-A1 Spirohydantoin compounds and methods for the modulation of chemokine receptor activity VIRO CHEM PHARMA, INC. (CA) 2005-04-07 US claimed
US-7351713-B2 Spirohydantoin compounds and methods for the modulation of chemokine receptor activity VIRO CHEM PHARMA, INC. (CA) 2008-04-01 US disclosed
US-7351713-B2 Spirohydantoin compounds and methods for the modulation of chemokine receptor activity VIRO CHEM PHARMA, INC. (CA) 2008-04-01 US disclosed
US-7351713-B2 Spirohydantoin compounds and methods for the modulation of chemokine receptor activity VIRO CHEM PHARMA, INC. (CA) 2008-04-01 US disclosed
US-20050075360-A1 Spirohydantoin compounds and methods for the modulation of chemokine receptor activity VIRO CHEM PHARMA, INC. (CA) 2005-04-07 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-20050075360-A1 Spirohydantoin compounds and methods for the modulation of chemokine receptor activity CXCR1, CXCR4, CXCR2 LMNA 4228/4885HTT 1911/4885NPC1 788/4885

“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.