SCHEMBL10606746

SCHEMBL10606746

CCc1cc(C(=O)O)cc([N+](=O)[O-])c1Cl

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.51
▸ MAPT P10636 1/20 0.51
▸ HCAR3 P49019 9/20 0.49
▸ PDK1 Q15118 1/20 0.49
▸ TSHR P16473 2/20 0.49
▸ CASP6 P55212 1/20 0.49
▸ TPMT P51580 1/20 0.48
▸ KMT2A Q03164 2/20 0.46
▸ POLB P06746 1/20 0.46
▸ LMNA P02545 1/20 0.45
▸ KDM4E B2RXH2 1/20 0.45
▸ MEN1 O00255 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.45

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
SCHEMBL10606736 0.89 GAA (0.51) GAAMAPTHCAR3PDK1TSHR
SCHEMBL3146159 0.84 CASP6 (0.60) GAAMAPTHCAR3TSHRCASP6
SCHEMBL10609093 0.83 KMT2A (0.49) MAPTPDK1KMT2APOLBLMNA
Hydrochloric Acid SCHEMBL10571715 0.83 CASP6 (0.58) GAAMAPTHCAR3TSHRCASP6
SCHEMBL10487699 0.82 TPMT (0.53) GAAMAPTHCAR3PDK1TSHR
SCHEMBL10607220 0.82 KMT2A (0.54) GAAMAPTPDK1KMT2APOLB
SCHEMBL10607962 0.81 GAA (0.51) GAAMAPTHCAR3PDK1TSHR
SCHEMBL27628930 0.81 LMNA (0.53) GAAMAPTHCAR3PDK1TSHR
SCHEMBL10609914 0.80 TSHR (0.60) GAAMAPTHCAR3TSHRCASP6
SCHEMBL10609112 0.80 ESR1 (0.55) MAPTPDK1TSHRKMT2APOLB

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-0206635-B1 PREPARATION OF 3-AMINO-4-HYDROXYBENZOIC ACIDS THE DOW CHEMICAL COMPANY (US) 1989-11-15 — — EP disclosed
EP-0206635-A1 Preparation of 3-amino-4-hydroxybenzoic acids THE DOW CHEMICAL COMPANY (US) 1986-12-30 — — EP disclosed
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