SCHEMBL6409912

SCHEMBL6409912

Cc1ccc(C(=O)NCc2cc(-c3ccc(C)cc3C)no2)cc1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 3/20 0.53
HDAC1 Q13547 3/20 0.53
TDP1 Q9NUW8 2/20 0.49
MAPT P10636 5/20 0.43
TP53 P04637 2/20 0.43
POLB P06746 3/20 0.43
LMNA P02545 2/20 0.41
PLA2G1B P04054 1/20 0.41
ATG4B Q9Y4P1 1/20 0.41
ALDH1A1 P00352 3/20 0.41
TSHR P16473 1/20 0.41
HSD17B10 Q99714 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
CYP1A2 P05177 1/20 0.41
RAB9A P51151 2/20 0.41
NPC1 O15118 1/20 0.41
HTT P42858 1/20 0.41
ROCK2 O75116 1/20 0.41

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
SCHEMBL6407970 0.85 POLB (0.59) KDM1AHDAC1TDP1MAPTTP53
SCHEMBL6403149 0.81 NPC1 (0.57) KDM1AHDAC1TDP1MAPTPOLB
SCHEMBL6402397 0.81 SMN1; SMN2 (0.52) TDP1MAPTTP53POLBLMNA
SCHEMBL6410101 0.81 POLB (0.54) KDM1AHDAC1TDP1MAPTTP53
SCHEMBL6404127 0.81 POLB (0.54) KDM1AHDAC1TDP1MAPTTP53
SCHEMBL6403802 0.81 ROCK2 (0.57) KDM1AHDAC1TDP1MAPTPOLB
SCHEMBL6406602 0.80 SMN1; SMN2 (0.50) KDM1AHDAC1MAPTPOLBLMNA
SCHEMBL6403578 0.80 EPHX2 (0.54) KDM1AHDAC1TDP1MAPTPOLB
SCHEMBL6404351 0.80 SMN1; SMN2 (0.57) KDM1AHDAC1TDP1MAPTTP53
SCHEMBL6407414 0.79 MAPT (0.47) KDM1AHDAC1TDP1MAPTTP53

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-20050171358-A1 Substituted isoxazole alkylamine derivative and agri-and horticultural fungicide SDS BIOTECH K.K. (JP) 2005-08-04 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-20050171358-A1 Substituted isoxazole alkylamine derivative and agri-and horticultural fungicide AHR, ERG28, CYP1A2 KDM1A 936/4885HDAC1 588/4885TDP1 1721/4885

“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.