SCHEMBL10176642

SCHEMBL10176642

CCc1ccc(-c2ccc3c(c2)nc2n3CCN(C(C)C3CCC3)CC2)cc1

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TP53 P04637 11/20 0.39
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
MAPT P10636 4/20 0.35
KDM4E B2RXH2 3/20 0.35
ALDH1A1 P00352 3/20 0.35
HPGD P15428 1/20 0.35
MAPK1 P28482 1/20 0.35
LMNA P02545 2/20 0.34
GAA P10253 1/20 0.33
SMN1; SMN2 Q16637 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
SCHEMBL7886301 0.91 NOS3 (0.37) TP53MEN1KMT2AMAPTKDM4E
SCHEMBL10176643 0.89 TP53 (0.37) TP53MEN1KMT2AMAPTKDM4E
SCHEMBL7886200 0.85 USP30 (0.37) TP53MAPTKDM4EALDH1A1HPGD
SCHEMBL10176644 0.82 SMN1; SMN2 (0.40) TP53MEN1KMT2AMAPTKDM4E
SCHEMBL7888566 0.82 PTGS2 (0.36) TP53MAPTKDM4EALDH1A1HPGD
SCHEMBL10176885 0.81 MAPT (0.46) TP53MEN1KMT2AMAPTKDM4E
SCHEMBL7890081 0.81 ACHE (0.40) TP53MEN1KMT2AMAPTKDM4E
SCHEMBL418938 0.79 SPHK1 (0.35) TP53
SCHEMBL421118 0.78 ALDH1A1 (0.52) TP53MEN1KMT2AMAPTKDM4E
SCHEMBL10176660 0.76 MAPT (0.40) TP53MEN1KMT2AMAPTKDM4E

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-8404670-B2 Histamine H3 inverse agonists and antagonists and methods of use thereof SUNOVION PHARMACEUTICALS INC. (US) 2013-03-26 US disclosed
US-20120022050-A1 HISTAMINE H3 INVERSE AGONISTS AND ANTAGONISTS AND METHODS OF USE THEREOF SUNOVION PHARMACEUTICALS INC. 2012-01-26 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-20120022050-A1 HISTAMINE H3 INVERSE AGONISTS AND ANTAGONISTS AND METHODS OF USE THEREOF HRH3, HRH4, HRH2 TP53 4740/4885MEN1 1057/4885KMT2A 453/4885

“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.