SCHEMBL13635560

SCHEMBL13635560

Cc1cccc(-n2c(=O)ccc3cc(C(=O)N4CCCC4)[nH]c32)c1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
HPGD P15428 3/20 0.45
HRH4 Q9H3N8 8/20 0.43
LMNA P02545 2/20 0.42
TP53 P04637 2/20 0.42
MAPT P10636 2/20 0.42
THRB P10828 1/20 0.42
HTT P42858 1/20 0.41
KMT2A Q03164 2/20 0.41
PLA2G7 Q13093 1/20 0.41
ALDH1A1 P00352 1/20 0.41
GLA P06280 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HRH3 Q9Y5N1 1/20 0.40
PTK2B Q14289 1/20 0.40
MEN1 O00255 1/20 0.39

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
SCHEMBL10059703 0.88 PLA2G7 (0.44) NPC1RAB9AHPGDHRH4LMNA
SCHEMBL13635543 0.83 ALKBH5 (0.53) HPGDLMNAMAPTHTTKMT2A
SCHEMBL10059651 0.81 HRH4 (0.54) NPC1RAB9AHRH4LMNATP53
SCHEMBL10059609 0.81 KMT2A (0.47) NPC1RAB9AHRH4LMNATP53
SCHEMBL14886291 0.79 HRH4 (0.57) NPC1RAB9AHRH4HRH3
SCHEMBL14886545 0.79 HRH4 (0.50) NPC1RAB9AHRH4KMT2AHRH3
SCHEMBL10059625 0.78 HRH4 (0.47) NPC1RAB9AHPGDHRH4LMNA
SCHEMBL17612689 0.78 HRH4 (0.40) NPC1RAB9AHRH4LMNATP53
SCHEMBL14886290 0.78 POLB (0.49) NPC1RAB9AHPGDHRH4TP53
SCHEMBL10059588 0.78 KMT2A (0.45) NPC1RAB9AHRH4LMNATP53

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-20130102597-A1 COMPOUNDS AND METHODS FOR TREATING INFLAMMATORY AND FIBROTIC DISORDERS INTERMUNE, INC. (US) 2013-04-25 US disclosed
US-8304413-B2 Compounds and methods for treating inflammatory and fibrotic disorders INTERMUNE, INC. (US) 2012-11-06 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-20130102597-A1 COMPOUNDS AND METHODS FOR TREATING INFLAMMATORY AND FIBROTIC DISORDERS MAP3K8, MAP3K1, MAP3K6 NPC1 3195/4885RAB9A 2764/4885HPGD 529/4885

“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.