SCHEMBL13576459

SCHEMBL13576459

Clc1ccc(/N=C/c2ccc3c(c2)OCO3)nc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.50
NPC1 O15118 4/20 0.50
RAB9A P51151 4/20 0.50
SMN1; SMN2 Q16637 4/20 0.50
LMNA P02545 1/20 0.50
CYP1A2 P05177 3/20 0.48
CYP3A4 P08684 3/20 0.48
CYP2D6 P10635 3/20 0.48
CYP2C19 P33261 3/20 0.48
CYP2C9 P11712 2/20 0.48
PLAU P00749 1/20 0.47
ALDH1A1 P00352 7/20 0.47
HSD17B10 Q99714 2/20 0.47
TP53 P04637 1/20 0.47
KMT2A Q03164 5/20 0.46
MAPT P10636 4/20 0.45
MEN1 O00255 4/20 0.45
HPGD P15428 2/20 0.45
GAA P10253 2/20 0.45
GRIN2D O15399 1/20 0.44

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
SCHEMBL13560879 0.76 NPC1 (0.59) KDM4ENPC1RAB9ASMN1; SMN2LMNA
SCHEMBL7267356 0.72 KMT2A (0.45) KDM4ENPC1RAB9ASMN1; SMN2LMNA
SCHEMBL7267353 0.72 KMT2A (0.45) KDM4ENPC1RAB9ASMN1; SMN2LMNA
SCHEMBL11774241 0.70 GRIN2D (0.70) KDM4ENPC1RAB9ASMN1; SMN2LMNA
SCHEMBL11774250 0.70 GRIN2D (0.70) KDM4ENPC1RAB9ASMN1; SMN2LMNA
SCHEMBL22198272 0.70 GRIN2D (0.70) KDM4ENPC1RAB9ASMN1; SMN2LMNA
SCHEMBL13561062 0.70 CYP19A1 (0.69) KDM4ENPC1RAB9ASMN1; SMN2LMNA
SCHEMBL12416591 0.69 CYP1A2 (0.61) KDM4ENPC1RAB9ASMN1; SMN2CYP1A2
SCHEMBL16274602 0.69 CYP1A2 (0.61) KDM4ENPC1RAB9ASMN1; SMN2CYP1A2
SCHEMBL6582867 0.69 ALDH1A1 (0.64) KDM4ENPC1RAB9ALMNACYP1A2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8507546-B2 Use of inhibitors of scavenger receptor class proteins for the treatment of infectious diseases INSTITUTO DE MEDICINA MOLECULAR, FACULDADE DE MEDICINA DA UNIVERSIDADE DE LISBOA (PT) 2013-08-13 US disclosed
US-8507546-B2 Use of inhibitors of scavenger receptor class proteins for the treatment of infectious diseases INSTITUTO DE MEDICINA MOLECULAR, FACULDADE DE MEDICINA DA UNIVERSIDADE DE LISBOA (PT) 2013-08-13 US disclosed
US-20090324580-A1 Use of Inhibitors of Scavenger Receptor Class Proteins for the Treatment of Infectious Diseases CENIX BIOSCIENCE GMBH (DE) 2009-12-31 US disclosed
US-20090324580-A1 Use of Inhibitors of Scavenger Receptor Class Proteins for the Treatment of Infectious Diseases CENIX BIOSCIENCE GMBH (DE) 2009-12-31 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-20090324580-A1 Use of Inhibitors of Scavenger Receptor Class Proteins for the Treatment of Infectious Diseases SCARB1, MSR1, HAVCR2 KDM4E 4698/4885NPC1 111/4885RAB9A 1744/4885

“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.