SCHEMBL8429196

SCHEMBL8429196

Cc1ccc[n+](CB(c2ccccc2)c2ccccc2)c1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PABPC1 P11940 1/20 0.50
▸ KMT2A Q03164 1/20 0.50
▸ ATM Q13315 1/20 0.50
▸ LMNA P02545 5/20 0.45
▸ KDM4E B2RXH2 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ GGPS1 O95749 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ TSHR P16473 1/20 0.37
▸ ALOX12 P18054 1/20 0.37
▸ ACHE P22303 1/20 0.37
▸ GLA P06280 1/20 0.37
▸ HTT P42858 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL8424992 0.79 KMT2A (0.41) PABPC1KMT2AATMLMNAALDH1A1
SCHEMBL8630008 0.75 GGPS1 (0.41) KMT2AGGPS1
SCHEMBL6114429 0.74 PABPC1 (0.50) PABPC1KMT2AATMLMNAKDM4E
SCHEMBL6114658 0.74 PABPC1 (0.50) PABPC1KMT2AATMLMNAKDM4E
SCHEMBL5286396 0.74 LMNA (0.61) PABPC1KMT2AATMLMNAKDM4E
SCHEMBL30192808 0.74 LMNA (0.61) PABPC1KMT2AATMLMNAKDM4E
Bromide SCHEMBL17105097 0.73 LMNA (0.62) PABPC1KMT2AATMLMNAKDM4E
Hydrochloric Acid SCHEMBL5155050 0.73 LMNA (0.65) PABPC1KMT2AATMLMNAKDM4E
SCHEMBL29556923 0.73 — —
SCHEMBL294294 0.73 — —

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
US-5958900-A Use of organoboron compounds as antifouling agents AMERICAN CYANAMID COMPANY (US) 1999-09-28 — — US claimed
WO-1997042823-A1 USE OF ORGANOBORON COMPOUNDS AS ANTIFOULING AGENTS AMERICAN CYANAMID COMPANY (US) 1997-11-20 — — WO claimed
US-5958900-A Use of organoboron compounds as antifouling agents AMERICAN CYANAMID COMPANY (US) 1999-09-28 — — US disclosed
WO-1997042823-A1 USE OF ORGANOBORON COMPOUNDS AS ANTIFOULING AGENTS AMERICAN CYANAMID COMPANY (US) 1997-11-20 — — WO disclosed
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