SCHEMBL1868600

SCHEMBL1868600

NC1c2ccccc2N(Cc2ccccc2)c2ccccc21

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 1/20 0.49
ELANE P08246 2/20 0.45
F2 P00734 1/20 0.45
PLG P00747 1/20 0.45
CTSG P08311 1/20 0.45
CMA1 P23946 1/20 0.45
CTRC Q99895 1/20 0.45
P2RX1 P51575 1/20 0.45
P2RX3 P56373 1/20 0.45
P2RX4 Q99571 1/20 0.45
P2RX7 Q99572 1/20 0.45
ALDH1A1 P00352 5/20 0.43
ALDH2 P05091 1/20 0.43
CHRM1 P11229 1/20 0.43
CES1 P23141 1/20 0.43
ALDH3A1 P30838 1/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
GSK3A P49840 1/20 0.42
GSK3B P49841 1/20 0.42

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
SCHEMBL3366450 0.82 POLB (0.38) RXFP1ELANEF2PLGCTSG
SCHEMBL31310490 0.79 RXFP1 (0.63) RXFP1ELANEF2PLGCTSG
SCHEMBL3859755 0.77 RXFP1 (0.49) RXFP1ELANEF2PLGCTSG
SCHEMBL12297902 0.74 MEN1 (0.49) ELANEF2PLGCTSGCMA1
SCHEMBL38661561 0.73 PARK7 (0.52) ELANEF2PLGCTSGCMA1
SCHEMBL29385257 0.73 MEN1 (0.61) ELANEF2PLGCTSGCMA1
SCHEMBL2873764 0.72 HDAC4 (0.60) RXFP1ELANEF2PLGCTSG
SCHEMBL6825068 0.72 CACNA1G (0.55) ELANEF2PLGCTSGCMA1
SCHEMBL21666455 0.71 ALDH1A1 (0.63) RXFP1ELANEF2PLGCTSG
SCHEMBL2608501 0.71 P2RX1 (0.40) RXFP1ELANEF2PLGCTSG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2493857-A1 9-AMINOACRIDINE DERIVATIVES, THEIR PREPARATION AND USES Ariel-University Research and Development Company Ltd. (IL) 2012-09-05 EP disclosed
US-20120220537-A1 9-AMINOACRIDINE DERIVATIVES, THEIR PREPARATION AND USES ARIEL-UNIVERSITY RESEARCH AND DEVELOPMENT COMPANY LTD. (IL) 2012-08-30 US disclosed
WO-2011051950-A1 9-AMINOACRIDINE DERIVATIVES, THEIR PREPARATION AND USES ARIEL-UNIVERSITY RESEARCH AND DEVELOPMENT COMPANY LTD (IL) 2011-05-05 WO 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-20120220537-A1 9-AMINOACRIDINE DERIVATIVES, THEIR PREPARATION AND USES MPG, PRMT9, AADAT RXFP1 4560/4885ELANE 219/4885F2 4815/4885

“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.