SCHEMBL11415349

SCHEMBL11415349

Cc1cc(Cl)ccc1N=Cc1cccc(C(=O)O)c1C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.43
▸ HPGD P15428 4/20 0.43
▸ L3MBTL1 Q9Y468 4/20 0.43
▸ LMNA P02545 3/20 0.43
▸ KDM4E B2RXH2 3/20 0.43
▸ TSHR P16473 2/20 0.43
▸ HSD17B10 Q99714 2/20 0.43
▸ POLB P06746 2/20 0.43
▸ MAPT P10636 2/20 0.43
▸ MPI P34949 2/20 0.43
▸ GAA P10253 2/20 0.43
▸ THRB P10828 1/20 0.43
▸ PKM P14618 1/20 0.43
▸ ALOX15 P16050 1/20 0.43
▸ ALOX12 P18054 1/20 0.43
▸ TLR2 O60603 1/20 0.43
▸ TLR1 Q15399 1/20 0.43
▸ TLR6 Q9Y2C9 1/20 0.43
▸ KMT2A Q03164 4/20 0.42
▸ MEN1 O00255 3/20 0.42

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
SCHEMBL11415344 1.00 ALDH1A1 (0.43) ALDH1A1HPGDL3MBTL1LMNAKDM4E
SCHEMBL11415330 0.80 TLR2 (0.53) ALDH1A1HPGDL3MBTL1LMNAKDM4E
SCHEMBL11415326 0.80 TLR2 (0.53) ALDH1A1HPGDL3MBTL1LMNAKDM4E
SCHEMBL11408875 0.79 MEN1 (0.45) ALDH1A1HPGDKDM4ETSHRHSD17B10
SCHEMBL11408874 0.79 MEN1 (0.45) ALDH1A1HPGDKDM4ETSHRHSD17B10
SCHEMBL11424611 0.78 ALDH1A1 (0.46) ALDH1A1HPGDL3MBTL1LMNAKDM4E
SCHEMBL11424615 0.78 ALDH1A1 (0.46) ALDH1A1HPGDL3MBTL1LMNAKDM4E
SCHEMBL11408171 0.75 ALDH1A1 (0.58) ALDH1A1HPGDL3MBTL1LMNAKDM4E
SCHEMBL11408167 0.75 ALDH1A1 (0.58) ALDH1A1HPGDL3MBTL1LMNAKDM4E
SCHEMBL11404916 0.75 LMNA (0.50) ALDH1A1HPGDL3MBTL1LMNAKDM4E

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-4200648-A INFLAMMATION BY ADMINISTERING A BENZYLIDENEANILINE DERIVATIVE WILLIAM H. RORER, INC. (US) 1980-04-29 — — US disclosed
US-4198349-A ANTIINFLAMMATORY, TOPICAL WILLIAM H. RORER, INC. (US) 1980-04-15 — — US disclosed
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