SCHEMBL11761443

SCHEMBL11761443

CCCCCCC=CCCCCCCCCCC(=O)Oc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BCL9 O00512 1/20 0.67
▸ CTNNB1 P35222 1/20 0.67
▸ MGLL Q99685 2/20 0.57
▸ FABP3 P05413 3/20 0.49
▸ ALDH1A1 P00352 5/20 0.48
▸ KMT2A Q03164 1/20 0.48
▸ SMN1; SMN2 Q16637 1/20 0.48
▸ POLM Q9NP87 1/20 0.47
▸ POLK Q9UBT6 1/20 0.47
▸ POLL Q9UGP5 1/20 0.47
▸ POLH Q9Y253 1/20 0.47
▸ CNR1 P21554 1/20 0.47
▸ KDM4E B2RXH2 3/20 0.47
▸ F7 P08709 3/20 0.47
▸ F3 P13726 3/20 0.47
▸ PPARG P37231 2/20 0.47
▸ PPARD Q03181 2/20 0.47
▸ PPARA Q07869 2/20 0.47
▸ DUSP3 P51452 1/20 0.47
▸ PTPN7 P35236 1/20 0.47

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
SCHEMBL11761431 1.00 BCL9 (0.67) BCL9CTNNB1MGLLFABP3ALDH1A1
SCHEMBL1942724 1.00 BCL9 (0.67) BCL9CTNNB1MGLLFABP3ALDH1A1
SCHEMBL13729888 1.00 BCL9 (0.67) BCL9CTNNB1MGLLFABP3ALDH1A1
SCHEMBL13164410 1.00 BCL9 (0.67) BCL9CTNNB1MGLLFABP3ALDH1A1
SCHEMBL1942721 1.00 BCL9 (0.67) BCL9CTNNB1MGLLFABP3ALDH1A1
SCHEMBL5454330 0.99 BCL9 (0.65) BCL9CTNNB1MGLLFABP3ALDH1A1
SCHEMBL13184391 0.93 BCL9 (0.63) BCL9CTNNB1MGLLFABP3ALDH1A1
SCHEMBL9615216 0.92 BCL9 (0.57) BCL9CTNNB1MGLLFABP3ALDH1A1
SCHEMBL22531036 0.92 BCL9 (0.78) BCL9CTNNB1MGLLALDH1A1KMT2A
SCHEMBL136672 0.92 BCL9 (0.78) BCL9CTNNB1MGLLALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4021449-A ANTITUMOR AND LIPID SOLUBILIZER KYOWA HAKKO KOGYO CO., LTD. (JA) 1977-05-03 — — US disclosed
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