SCHEMBL4500369

SCHEMBL4500369

CCN1/C(=C\C=C\C=C2\C(=O)c3ccccc3S2(=O)=O)Sc2ccccc21

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 15/20 0.49
▸ KMT2A Q03164 15/20 0.49
▸ MAPT P10636 12/20 0.49
▸ ALDH1A1 P00352 10/20 0.49
▸ RAB9A P51151 8/20 0.49
▸ NPC1 O15118 7/20 0.49
▸ MAPK1 P28482 5/20 0.49
▸ THRB P10828 3/20 0.49
▸ USP2 O75604 4/20 0.48
▸ CRHBP P24387 2/20 0.48
▸ CRHR2 Q13324 2/20 0.48
▸ IDE P14735 1/20 0.48
▸ LMNA P02545 2/20 0.47
▸ HTT P42858 6/20 0.46
▸ HPGD P15428 2/20 0.46
▸ SMN1; SMN2 Q16637 5/20 0.45
▸ BLM P54132 3/20 0.45
▸ POLB P06746 3/20 0.44
▸ KDM4E B2RXH2 2/20 0.44
▸ ALOX12 P18054 2/20 0.44

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
SCHEMBL2057351 1.00 MEN1 (0.49) MEN1KMT2AMAPTALDH1A1RAB9A
SCHEMBL2057354 1.00 MEN1 (0.49) MEN1KMT2AMAPTALDH1A1RAB9A
SCHEMBL2057356 1.00 MEN1 (0.49) MEN1KMT2AMAPTALDH1A1RAB9A
SCHEMBL3196262 0.83 MMP13 (0.42) MEN1KMT2AMAPTALDH1A1RAB9A
SCHEMBL3196246 0.83 MMP13 (0.42) MEN1KMT2AMAPTALDH1A1RAB9A
SCHEMBL4503906 0.82 KDM4E (0.52) MEN1KMT2AMAPTALDH1A1RAB9A
SCHEMBL4503913 0.82 KDM4E (0.52) MEN1KMT2AMAPTALDH1A1RAB9A
SCHEMBL2057371 0.80 MEN1 (0.36) MEN1KMT2AMAPTALDH1A1RAB9A
SCHEMBL2057377 0.80 MEN1 (0.36) MEN1KMT2AMAPTALDH1A1RAB9A
SCHEMBL10036069 0.78 MEN1 (0.54) MEN1KMT2AMAPTALDH1A1RAB9A

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-7592188-B2 environmentally sensitive fluorescent dye covalently linked to a binding domain which has specific affinity for a target molecule; fluorescence resonance energy transfer; detecting changes in the binding, conformational change; detecting human immunodeficiency virus THE SCRIPPS RESEARCH INSTITUTE (US) 2009-09-22 — — US disclosed
US-20060029946-A1 Live cell biosensors NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2006-02-09 — — US disclosed
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