SCHEMBL2731589

SCHEMBL2731589

O=Cc1ccc(-n2c(C(=O)O)c(Cl)c3ccccc32)cc1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ FOLH1 Q04609 2/20 0.46
▸ ALDH1A1 P00352 5/20 0.43
▸ KDM4E B2RXH2 3/20 0.43
▸ LMNA P02545 2/20 0.43
▸ PSMD14 O00487 1/20 0.43
▸ MEN1 O00255 3/20 0.42
▸ KMT2A Q03164 3/20 0.42
▸ POLB P06746 2/20 0.42
▸ CCR2 P41597 1/20 0.42
▸ USP2 O75604 1/20 0.42
▸ L3MBTL1 Q9Y468 2/20 0.41
▸ THRB P10828 1/20 0.41
▸ RORC P51449 1/20 0.41
▸ EDNRA P25101 2/20 0.39
▸ EDNRB P24530 1/20 0.39
▸ PPARG P37231 3/20 0.39
▸ PPARA Q07869 2/20 0.39
▸ ATM Q13315 1/20 0.39
▸ AGTR1 P30556 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
SCHEMBL2731177 0.84 MAPK8 (0.44) ALDH1A1KDM4EKMT2APOLB
SCHEMBL2730721 0.81 RECQL (0.49) ALDH1A1KDM4ELMNAMEN1KMT2A
SCHEMBL30462688 0.77 KDM4E (0.59) ALDH1A1KDM4EPOLBL3MBTL1ATM
SCHEMBL29387787 0.77 KDM4E (0.59) ALDH1A1KDM4EPOLBL3MBTL1ATM
SCHEMBL39208 0.77 KDM4E (0.59) ALDH1A1KDM4EPOLBL3MBTL1ATM
SCHEMBL29744440 0.72 KDM4E (0.53) ALDH1A1KDM4EMEN1KMT2APOLB
SCHEMBL28791262 0.72 KDM4E (0.53) ALDH1A1KDM4EMEN1KMT2APOLB
SCHEMBL21594507 0.72 KDM4E (0.53) ALDH1A1KDM4EMEN1KMT2APOLB
SCHEMBL7678729 0.71 PLA2G2A (0.51) FOLH1ALDH1A1KDM4EKMT2ACCR2
SCHEMBL28165405 0.71 KMT2A (0.53) FOLH1ALDH1A1KDM4ELMNAMEN1

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
EP-2635567-A1 INDOLE DERIVATIVES Richter Gedeon Nyrt. (HU) 2013-09-11 — — EP disclosed
WO-2012059776-A1 INDOLE DERIVATIVES RICHTER GEDEON NYRT. (HU) 2012-05-10 — — WO disclosed
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