SCHEMBL1820575

SCHEMBL1820575

Cc1cccc(N(C)C(=O)COc2ccccc2)c1C

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.52
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
MEN1 O00255 4/20 0.50
KMT2A Q03164 4/20 0.50
MLYCD O95822 2/20 0.49
KDM4E B2RXH2 2/20 0.45
TDP1 Q9NUW8 1/20 0.45
ALOX15 P16050 1/20 0.45
MAPK1 P28482 2/20 0.44
HSD17B10 Q99714 1/20 0.44
MAPT P10636 2/20 0.44
THRB P10828 1/20 0.44
FFAR1 O14842 1/20 0.44
ALOX5 P09917 1/20 0.43
HTT P42858 1/20 0.43

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
SCHEMBL8034098 0.80 KMT2A (0.46) SMN1; SMN2MEN1KMT2AMLYCDKDM4E
SCHEMBL1820817 0.79 SMN1; SMN2 (0.51) SMN1; SMN2NPC1RAB9AMEN1KMT2A
SCHEMBL8036800 0.77 ALDH1A1 (0.53) SMN1; SMN2NPC1RAB9AMEN1KMT2A
SCHEMBL1820373 0.77 SMN1; SMN2 (0.49) SMN1; SMN2NPC1RAB9AMEN1KMT2A
SCHEMBL5696786 0.77 MLYCD (0.69) SMN1; SMN2NPC1RAB9AMEN1KMT2A
SCHEMBL31541280 0.76 SMN1; SMN2 (0.51) SMN1; SMN2NPC1RAB9AMEN1KMT2A
SCHEMBL11212156 0.75 RXRA (0.40) SMN1; SMN2NPC1RAB9AMEN1KMT2A
SCHEMBL3632818 0.74 SMN1; SMN2 (0.86) SMN1; SMN2NPC1RAB9AMEN1KMT2A
SCHEMBL11512487 0.74 ALDH1A1 (0.46) SMN1; SMN2MEN1KMT2AKDM4ETDP1
SCHEMBL25942822 0.72 MLYCD (0.59) SMN1; SMN2NPC1RAB9AMEN1KMT2A

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-7947712-B2 Antiarthritic agents; asthma; chronic obstructive pulminary diosrders; atherosclerosis; vision defects; hepatitis; central nervous system disorders; cardiovascular disorders; wound healing agents; restenosis; cirrhosis; multiple sclerosis; glomerulonephritis; graft versus host disease; antidiabetic agent WYETH LLC (US) 2011-05-24 US disclosed
US-20080269213-A1 8-Hydroxyquinoline compounds and methods thereof WYETH (US) 2008-10-30 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-20080269213-A1 8-Hydroxyquinoline compounds and methods thereof MMP8, MMP26, MMP9 SMN1; SMN2 598/4885NPC1 2196/4885RAB9A 699/4885

“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.