SCHEMBL8374809

SCHEMBL8374809

C[N]C(C)Oc1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.40
▸ CA4 P22748 1/20 0.40
▸ MTNR1A P48039 1/20 0.39
▸ MTNR1B P49286 1/20 0.39
▸ LMNA P02545 2/20 0.39
▸ GAA P10253 2/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ PKM P14618 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ CHRNB4 P30926 2/20 0.38
▸ CHRNA3 P32297 2/20 0.38
▸ MAOA P21397 2/20 0.38
▸ ADRA2A P08913 1/20 0.38
▸ ADRA2B P18089 1/20 0.38
▸ ADRA2C P18825 1/20 0.38
▸ MAOB P27338 1/20 0.38
▸ NISCH Q9Y2I1 1/20 0.38
▸ LTA4H P09960 2/20 0.38
▸ TSHR P16473 1/20 0.38

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
SCHEMBL7973687 0.76 MTNR1A (0.40) KDM4ECA4MTNR1AMTNR1BLMNA
SCHEMBL20213967 0.74 PDE2A (0.38) KDM4ECA4MTNR1AMTNR1BLMNA
SCHEMBL5325563 0.74 MTNR1A (0.39) KDM4ECA4MTNR1AMTNR1BLMNA
SCHEMBL542873 0.74 KDM4E (0.50) KDM4ECA4MTNR1AMTNR1BLMNA
SCHEMBL1453272 0.74 CA4 (0.48) KDM4ECA4MTNR1AMTNR1BLMNA
SCHEMBL12394 0.74 KMT2A (0.54) KDM4ECA4MTNR1AMTNR1BLMNA
Hydrogen Sulfide SCHEMBL27992657 0.72 KMT2A (0.52) KDM4ECA4MTNR1AMTNR1BLMNA
Phosphine SCHEMBL28772208 0.72 KMT2A (0.52) KDM4ECA4MTNR1AMTNR1BLMNA
Ammonia Solution, Strong SCHEMBL8909178 0.72 KMT2A (0.52) KDM4ECA4MTNR1AMTNR1BLMNA
SCHEMBL24925068 0.70 CA4 (0.43) KDM4ECA4MTNR1AMTNR1BLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5986042-A Cross-linked polymer MITSUI CHEMICALS, INC. (JP) 1999-11-16 — — US disclosed
EP-0856539-A1 Cross-linked polymer Mitsui Chemicals, Inc. (JP) 1998-08-05 — — EP disclosed
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