SCHEMBL8089461

SCHEMBL8089461

CC(N(CCO)c1ccccc1)N(CCO)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
TAAR1 Q96RJ0 2/20 0.40
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
ALDH1A1 P00352 4/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
TP53 P04637 2/20 0.38
LMNA P02545 1/20 0.38
TRPA1 O75762 2/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
OPRM1 P35372 1/20 0.36
OPRL1 P41146 1/20 0.36
GLA P06280 1/20 0.35
TSHR P16473 1/20 0.35
POLB P06746 1/20 0.35
APOBEC3A P31941 1/20 0.35
APOBEC3G Q9HC16 1/20 0.35

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
SCHEMBL5754344 0.88 TAAR1 (0.47) KDM4EL3MBTL1TAAR1MEN1KMT2A
SCHEMBL30885596 0.86 KDM4E (0.49) KDM4EL3MBTL1TAAR1MEN1KMT2A
SCHEMBL2772902 0.84 KDM4E (0.44) KDM4EL3MBTL1TAAR1MEN1KMT2A
SCHEMBL7592231 0.82 TRPA1 (0.44) KDM4EL3MBTL1TAAR1ALDH1A1TRPA1
SCHEMBL8430263 0.80 SIGMAR1 (0.50) KDM4EL3MBTL1TAAR1TRPA1TSHR
SCHEMBL9015922 0.78 KDM4E (0.40) KDM4EL3MBTL1TAAR1MEN1KMT2A
SCHEMBL7594235 0.78 KDM4E (0.42) KDM4EL3MBTL1MEN1KMT2AALDH1A1
SCHEMBL27796477 0.78 KDM4E (0.46) KDM4EL3MBTL1TAAR1MEN1KMT2A
SCHEMBL8716261 0.77 TRPA1 (0.47) KDM4EL3MBTL1TAAR1TRPA1CYP3A4
SCHEMBL4975921 0.76 KDM4E (0.41) KDM4EL3MBTL1TAAR1MEN1KMT2A

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-0824576-B1 MULTILAYER SECOND-ORDER NONLINEAR OPTICAL FILMS OF HEAD-TO-HEAD MAINCHAIN CHROMOPHORIC POLYMERS US NAVY (US) 2000-12-13 EP disclosed
EP-0824576-A4 MULTILAYER SECOND-ORDER NONLINEAR OPTICAL FILMS OF HEAD-TO-HEAD MAINCHAIN CHROMOPHORIC POLYMERS US NAVY (US) 1998-04-15 EP disclosed
EP-0824576-A1 MULTILAYER SECOND-ORDER NONLINEAR OPTICAL FILMS OF HEAD-TO-HEAD MAINCHAIN CHROMOPHORIC POLYMERS THE GOVERNMENT OF THE UNITED STATES OF AMERICA as represented by THE SECRETARY OF THE NAVY (US) 1998-02-25 EP disclosed
WO-1996034928-A1 MULTILAYER SECOND-ORDER NONLINEAR OPTICAL FILMS OF HEAD-TO-HEAD MAINCHAIN CHROMOPHORIC POLYMERS THE GOVERNMENT OF THE UNITED STATES OF AMERICA, REPRESENTED BY THE SECRETARY OF THE NAVY (US) 1996-11-07 WO disclosed
US-5520968-A Multilayer second-order nonlinear optical films of head-to-head, mainchain chromophoric polymers THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 1996-05-28 US disclosed