SCHEMBL3580979

SCHEMBL3580979

Cc1nc(Cl)cn1CC(=O)OC(C)(C)C

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 3/20 0.38
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
KMT2A Q03164 3/20 0.36
HDAC6 Q9UBN7 2/20 0.36
HSP90AA1 P07900 1/20 0.34
HSP90AB1 P08238 1/20 0.34
LMNA P02545 1/20 0.33
P2RX7 Q99572 1/20 0.33
MITF O75030 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
STK17B O94768 1/20 0.32
STK17A Q9UEE5 1/20 0.32

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
SCHEMBL3587299 0.84 ALDH1A1 (0.38) FPR2KDM4EALDH1A1KMT2AHDAC6
SCHEMBL22058063 0.82 KDM4E (0.39) FPR2KDM4EALDH1A1KMT2AHDAC6
SCHEMBL13384299 0.77 FPR2 (0.35) FPR2KDM4EALDH1A1KMT2AHDAC6
SCHEMBL15335292 0.72 ALPL (0.47) FPR2KDM4EALDH1A1KMT2AHDAC6
SCHEMBL3581217 0.72 KDM4E (0.41) FPR2KDM4EALDH1A1KMT2AHDAC6
SCHEMBL3591115 0.72 CYP19A1 (0.45) FPR2KDM4EALDH1A1KMT2AHDAC6
SCHEMBL16293127 0.71 HDAC6 (0.40) FPR2KDM4EALDH1A1KMT2AHDAC6
SCHEMBL29427431 0.71 POLB (0.50) FPR2KDM4EALDH1A1KMT2AHDAC6
SCHEMBL10553435 0.71 FPR2 (0.51) FPR2KDM4EALDH1A1KMT2AHDAC6
SCHEMBL21262137 0.70 KDM4E (0.36) FPR2KDM4EALDH1A1KMT2AHDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100286191-A1 2-Arylthiazole Derivatives as CXCR3 Receptor Modulators MERCK SHARP & DOHME CORP. 2010-11-11 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-20100286191-A1 2-Arylthiazole Derivatives as CXCR3 Receptor Modulators CXCR3, CXCR1, CXCR2 FPR2 64/4885KDM4E 3447/4885ALDH1A1 971/4885

“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.