SCHEMBL10176643

SCHEMBL10176643

Cc1ccc(-c2ccc3c(c2)nc2n3CCN(C(C)C3CCC3)CC2)cc1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TP53 P04637 9/20 0.37
LMNA P02545 3/20 0.37
ALDH1A1 P00352 5/20 0.36
MAPT P10636 5/20 0.36
KDM4E B2RXH2 4/20 0.36
HPGD P15428 1/20 0.36
SMN1; SMN2 Q16637 3/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
USP2 O75604 1/20 0.34
GRM2 Q14416 1/20 0.34
USP30 Q70CQ3 1/20 0.33
GAA P10253 1/20 0.33
TDP1 Q9NUW8 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
SCHEMBL10176644 0.91 SMN1; SMN2 (0.40) TP53LMNAALDH1A1MAPTKDM4E
SCHEMBL10176642 0.89 TP53 (0.39) TP53LMNAALDH1A1MAPTKDM4E
SCHEMBL7886301 0.88 NOS3 (0.37) TP53LMNAALDH1A1MAPTKDM4E
SCHEMBL7886200 0.88 USP30 (0.37) TP53ALDH1A1MAPTKDM4EHPGD
SCHEMBL10176653 0.85 TP53 (0.39) TP53LMNAALDH1A1MAPTKDM4E
SCHEMBL7886212 0.85 MAPT (0.51) TP53ALDH1A1MAPTKDM4EHPGD
SCHEMBL7888566 0.84 PTGS2 (0.36) TP53ALDH1A1MAPTKDM4EHPGD
SCHEMBL7890081 0.84 ACHE (0.40) TP53ALDH1A1MAPTKDM4EHPGD
SCHEMBL421118 0.80 ALDH1A1 (0.52) TP53ALDH1A1MAPTKDM4EHPGD
SCHEMBL7889358 0.80 MAPT (0.45) TP53LMNAALDH1A1MAPTKDM4E

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 4740/4885LMNA 4701/4885ALDH1A1 2598/4885

“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.