SCHEMBL8554647

SCHEMBL8554647

COc1c2cccc1Cc1cccc(c1OC(=O)c1ccccc1)Cc1cccc(c1OC(=O)c1ccccc1)Cc1cccc(c1OC(=O)c1ccccc1)C2

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 2/20 0.47
▸ SLC6A3 Q01959 1/20 0.44
▸ CD69 Q07108 1/20 0.44
▸ TUBB4A P04350 1/20 0.43
▸ TUBB P07437 1/20 0.43
▸ TUBA3C P0DPH7 1/20 0.43
▸ TUBA1B P68363 1/20 0.43
▸ TUBA4A P68366 1/20 0.43
▸ TUBB4B P68371 1/20 0.43
▸ TUBB3 Q13509 1/20 0.43
▸ TUBB2A Q13885 1/20 0.43
▸ TUBB8 Q3ZCM7 1/20 0.43
▸ TUBA3E Q6PEY2 1/20 0.43
▸ TUBA1A Q71U36 1/20 0.43
▸ TUBA1C Q9BQE3 1/20 0.43
▸ TUBB6 Q9BUF5 1/20 0.43
▸ TUBB2B Q9BVA1 1/20 0.43
▸ TUBB1 Q9H4B7 1/20 0.43
▸ KMT2A Q03164 7/20 0.41
▸ MAPT P10636 5/20 0.41

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
SCHEMBL8217544 0.85 CD69 (0.45) TSHRCD69KMT2AMAPTNPSR1
SCHEMBL15541243 0.76 KDM4E (0.43) TSHRCD69TUBB4ATUBBTUBA3C
SCHEMBL28218043 0.76 SLC6A3 (0.57) TSHRSLC6A3KMT2AMAPTNPSR1
SCHEMBL9643432 0.76 KMT2A (0.55) TSHRSLC6A3KMT2AMAPTNPSR1
Hydroxyamine SCHEMBL11037119 0.74 CD69 (0.44) TSHRCD69TUBB4ATUBBTUBA3C
SCHEMBL9425229 0.74 SLC6A3 (0.55) TSHRSLC6A3KMT2AMAPTNPSR1
SCHEMBL5551848 0.74 LMNA (0.64) TSHRSLC6A3KMT2AMAPTNPSR1
SCHEMBL9514205 0.72 SMN1; SMN2 (0.56) TSHRSLC6A3KMT2AMAPTNPSR1
Fluorene SCHEMBL2708609 0.71 TSHR (0.68) TSHRSLC6A3KMT2AMAPTKDM4E
Fluorene SCHEMBL27412062 0.71 TSHR (0.68) TSHRSLC6A3KMT2AMAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0572599-B1 ION-SENSITIVE DYES KODAK LTD (GB) 1998-06-17 — — EP disclosed
US-5641684-A Ion-sensitive dyes JOHNSON & JOHNSON CLINICAL DIAGNOSTICS, INC. (US) 1997-06-24 — — US disclosed
EP-0572599-A1 ION-SENSITIVE DYES KODAK LIMITED (GB) 1993-12-08 — — EP disclosed
WO-1993012428-A1 ION-SENSITIVE DYES KODAK LIMITED (GB) 1993-06-24 — — WO disclosed
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