SCHEMBL1021465

SCHEMBL1021465

CCN(Cc1ccccc1)C[C@H]1COc2cccc(F)c2O1

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.49
LTA4H P09960 6/20 0.47
HPGD P15428 2/20 0.41
ADRA1D P25100 3/20 0.41
ADRA1A P35348 3/20 0.41
ADRA1B P35368 3/20 0.41
LMNA P02545 3/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
GAA P10253 1/20 0.40
ALOX5 P09917 1/20 0.38
NR1D1 P20393 1/20 0.38
CA2 P00918 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL1019545 0.91 KDM4E (0.41) KDM4ELTA4HHPGDADRA1DADRA1A
SCHEMBL1018053 0.82 LTA4H (0.40) KDM4ELTA4HHPGDLMNASMN1; SMN2
SCHEMBL1879135 0.82 CA2 (0.40) KDM4ELTA4HHPGDLMNASMN1; SMN2
SCHEMBL22204407 0.74 KDM4E (0.46) KDM4ELTA4HADRA1AL3MBTL1
SCHEMBL1019554 0.74 LTA4H (0.34) LTA4HHPGDLMNASMN1; SMN2MEN1
SCHEMBL1018752 0.73 CA2 (0.39) LTA4HHPGDLMNASMN1; SMN2MEN1
SCHEMBL8184470 0.73 CA2 (0.43) HPGDSMN1; SMN2ALOX5NR1D1CA2
SCHEMBL6974656 0.70 ADRA1A (0.47) HPGDADRA1DADRA1AADRA1BCA2
SCHEMBL1021052 0.70 ADRA1A (0.47) HPGDADRA1DADRA1AADRA1BCA2
SCHEMBL1019856 0.70 ADRA1D (0.60) HPGDADRA1DADRA1AADRA1BCA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2271634-B1 MODULATORS OF DOPAMINE NEUROTRANSMISSION INTEGRATIVE RES LAB SWEDEN AB (SE) 2014-02-12 EP disclosed
US-8524766-B2 Modulators of dopamine neurotransmission NSAB, FILIAL AF NEUROSEARCH SWEDEN AB, SVERIGE (DK) 2013-09-03 US disclosed
US-20110105461-A1 MODULATORS OF DOPAMINE NEUROTRANSMISSION NSAB, FILIAL AF NEUROSEARCH SWEDEN AB, SVERIGE (DK) 2011-05-05 US disclosed
EP-2271634-A1 MODULATORS OF DOPAMINE NEUROTRANSMISSION NSAB, Filial af NeuroSearch Sweden AB, Sverige (DK) 2011-01-12 EP disclosed
WO-2009133107-A1 MODULATORS OF DOPAMINE NEUROTRANSMISSION NSAB, FILIAL AF NEUROSEARCH SWEDEN AB, SVERIGE (DK) 2009-11-05 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-20110105461-A1 MODULATORS OF DOPAMINE NEUROTRANSMISSION DBH, SLC18A2, SLC6A3 KDM4E 1570/4885LTA4H 1989/4885HPGD 494/4885

“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.