SCHEMBL5356918

SCHEMBL5356918

CC(C)c1nn(C(C=O)N2CCN(c3ccc(F)cc3)CC2)c(C(C)C)c1Cl

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PANK3 Q9H999 1/20 0.37
MAPT P10636 6/20 0.37
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
RECQL P46063 1/20 0.36
LMNA P02545 2/20 0.36
TSHR P16473 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CCR1 P32246 2/20 0.36
SMO Q99835 1/20 0.35
CYP3A4 P08684 1/20 0.35
MMP13 P45452 1/20 0.35
MMP14 P50281 1/20 0.35
RAD52 P43351 1/20 0.35
ALDH1A1 P00352 2/20 0.35
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34
KDM4E B2RXH2 2/20 0.34

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
SCHEMBL4013769 0.78 MAPT (0.40) MAPTKMT2AMEN1RECQLLMNA
SCHEMBL6168244 0.74 MAPT (0.36) MAPTKMT2AMEN1LMNATSHR
SCHEMBL4304948 0.74 MAPT (0.37) MAPTKMT2AMEN1LMNATSHR
SCHEMBL4014410 0.73 KDM1A (0.39) MAPTLMNATSHRSMOCYP3A4
SCHEMBL4451438 0.73 CCR1 (0.61) CCR1
SCHEMBL3854887 0.72 CCR1 (0.52) CCR1
SCHEMBL4022521 0.72 CCR1 (0.62) CCR1
SCHEMBL4459923 0.71 HSP90AA1 (0.40) MAPTKMT2AMEN1LMNAALDH1A1
SCHEMBL6168372 0.71 GFER (0.42) MAPTKMT2AMEN1RECQLLMNA
SCHEMBL2876641 0.71 CCR1 (0.59) MAPTKMT2AMEN1CCR1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7157464-B2 Substituted piperazines CHEMOCENTRYX, INC. (US) 2007-01-02 US disclosed
US-20040082571-A1 Substituted piperazines CHEMOCENTRYX, INC. (US) 2004-04-29 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-20040082571-A1 Substituted piperazines CCR1, CCR3, CCRL2 PANK3 2326/4885MAPT 3524/4885KMT2A 3499/4885

“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.