SCHEMBL16075825

SCHEMBL16075825

C=C(C)C(=O)OCc1ccccc1-c1c2ccc(=[N+](CC)CC)cc-2oc2cc(N(CC)CC)ccc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.54
▸ BLM P54132 2/20 0.54
▸ KMT2A Q03164 2/20 0.54
▸ USP2 O75604 1/20 0.54
▸ POLB P06746 1/20 0.54
▸ PPARG P37231 1/20 0.54
▸ RXFP1 Q9HBX9 1/20 0.54
▸ NCOR2 Q9Y618 1/20 0.54
▸ FPR2 P25090 4/20 0.45
▸ TGM2 P21980 1/20 0.44
▸ CHRM1 P11229 2/20 0.41
▸ THRB P10828 1/20 0.39
▸ RECQL P46063 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ TLR7 Q9NYK1 1/20 0.39
▸ AVPR2 P30518 2/20 0.39
▸ NPY4R P50391 3/20 0.38
▸ SLC6A2 P23975 1/20 0.37
▸ SLC6A4 P31645 1/20 0.37
▸ SLC6A3 Q01959 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
SCHEMBL18829074 0.93 MEN1 (0.51) MEN1BLMKMT2AUSP2POLB
SCHEMBL16075824 0.93 MEN1 (0.46) MEN1BLMKMT2AUSP2POLB
SCHEMBL13609836 0.87 USP2 (0.52) MEN1BLMKMT2AUSP2POLB
SCHEMBL17532633 0.85 MEN1 (0.51) MEN1BLMKMT2AUSP2POLB
SCHEMBL20288667 0.85 MEN1 (0.50) MEN1BLMKMT2AUSP2POLB
SCHEMBL17693122 0.85 MEN1 (0.50) MEN1BLMKMT2AUSP2POLB
SCHEMBL20286054 0.84 MEN1 (0.48) MEN1BLMKMT2AUSP2POLB
SCHEMBL15704723 0.84 MEN1 (0.61) MEN1BLMKMT2AUSP2POLB
SCHEMBL9001017 0.83 MEN1 (0.57) MEN1BLMKMT2AUSP2POLB
Rhodamine B SCHEMBL10000882 0.82 MEN1 (0.61) MEN1BLMKMT2AUSP2POLB

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
US-20160202247-A1 PHOTO-PATTERNABLE OPTICAL LUMINESCENCE DUAL SENSORS AND METHODS OF PREPARING AND USING THEM NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2016-07-14 — — US disclosed
US-20140273043-A1 TRI-COLOR DUAL GLUCOSE AND OXYGEN SENSORS AND METHODS OF PREPARING AND USING THEM NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2014-09-18 — — US disclosed
US-20140273043-A1 TRI-COLOR DUAL GLUCOSE AND OXYGEN SENSORS AND METHODS OF PREPARING AND USING THEM NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2014-09-18 — — US disclosed
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