SCHEMBL3761802

SCHEMBL3761802

NC(N)(Cc1ccccc1)C(=O)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.57
HIF1A Q16665 1/20 0.57
CES1 P23141 4/20 0.47
SLC6A2 P23975 2/20 0.47
TAAR1 Q96RJ0 1/20 0.47
PTPN1 P18031 1/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
ARG1 P05089 1/20 0.41
ARG2 P78540 1/20 0.41
TDP1 Q9NUW8 4/20 0.41
CYP2C19 P33261 2/20 0.41
CYP3A4 P08684 2/20 0.41
MAPT P10636 2/20 0.41
TSHR P16473 2/20 0.41
POLB P06746 1/20 0.41
PARP1 P09874 1/20 0.41
RECQL P46063 1/20 0.41
BLM P54132 1/20 0.41
PMP22 Q01453 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
SCHEMBL11398519 0.82 SMN1; SMN2 (0.50) SMN1; SMN2HIF1ACES1SLC6A2TAAR1
SCHEMBL1081531 0.81 SMN1; SMN2 (0.69) SMN1; SMN2HIF1ACES1SLC6A2TAAR1
SCHEMBL10666836 0.81 SMN1; SMN2 (0.75) SMN1; SMN2HIF1ACES1SLC6A2TAAR1
SCHEMBL2225057 0.81 SMN1; SMN2 (0.75) SMN1; SMN2HIF1ACES1SLC6A2TAAR1
SCHEMBL7104524 0.80 SLC6A2 (0.52) SMN1; SMN2HIF1ACES1SLC6A2TAAR1
SCHEMBL14518075 0.78 SMN1; SMN2 (0.48) SMN1; SMN2HIF1ACES1SLC6A2PTPN1
SCHEMBL9631851 0.78 CES1 (0.48) SMN1; SMN2HIF1ACES1TDP1CYP2C19
SCHEMBL28824751 0.77 SMN1; SMN2 (0.48) SMN1; SMN2HIF1ACES1SLC6A2TAAR1
SCHEMBL8459206 0.76 MMP8 (0.50) SMN1; SMN2HIF1ACES1SLC6A2TAAR1
SCHEMBL8695907 0.76 CES1 (0.57) SMN1; SMN2HIF1ACES1SLC6A2TAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7642367-B2 Diamino-functional chalcones LICA PHARMACEUTICALS A/S (DK) 2010-01-05 US disclosed
US-20080027075-A1 Quaternary Amino-Function Chalcones LICA PHARMACEUTICALS A/S (DK) 2008-01-31 US disclosed
US-20060235073-A1 Diamino-functional chalcones LICA PHARMACEUTICALS A/S (DK) 2006-10-19 US disclosed
EP-1682486-A1 QUATERNARY AMINO-FUNCTIONAL CHALCONES Lica Pharmaceuticals A/S (DK) 2006-07-26 EP disclosed
WO-2005042467-A1 QUATERNARY AMINO-FUNCTIONAL CHALCONES LICA PHARMACEUTICALS A/S (DK) 2005-05-12 WO disclosed
EP-1506158-A2 DIAMINO-FUNCTIONAL CHALCONES Lica Pharmaceuticals A/S (DK) 2005-02-16 EP disclosed
WO-2003097576-A2 DIAMINO-FUNCTIONAL CHALCONES LICA PHARMACEUTICALS A/S (DK) 2003-11-27 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-20080027075-A1 Quaternary Amino-Function Chalcones NR2E1, BET1, NR0B1 SMN1; SMN2 4360/4885HIF1A 1928/4885CES1 2022/4885

“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.