SCHEMBL9537375

SCHEMBL9537375

O=C(O)c1cc(Cl)ccc1Nc1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MPO P05164 1/20 0.68
AKR1C3 P42330 4/20 0.62
AKR1C2 P52895 4/20 0.62
DHODH Q02127 1/20 0.61
MEN1 O00255 2/20 0.61
LMNA P02545 2/20 0.61
GFER P55789 2/20 0.61
KMT2A Q03164 2/20 0.61
FABP4 P15090 2/20 0.61
FABP3 P05413 1/20 0.61
HPGD P15428 1/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
MAPT P10636 2/20 0.60
POLB P06746 1/20 0.60
NGLY1 Q96IV0 1/20 0.60
CTSV O60911 1/20 0.59
CTSL P07711 1/20 0.59
KDM4E B2RXH2 1/20 0.58
HSD17B10 Q99714 1/20 0.58
GRIK1 P39086 1/20 0.56

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
SCHEMBL31500229 0.91 AKR1C3 (0.72) MPOAKR1C3AKR1C2DHODHMEN1
SCHEMBL11604753 0.87 KDM4E (0.68) MPOAKR1C3AKR1C2DHODHMEN1
SCHEMBL846925 0.87 AKR1C3 (0.59) MPOAKR1C3AKR1C2DHODHMEN1
SCHEMBL5927337 0.87 MPO (0.53) MPOAKR1C3AKR1C2DHODHMEN1
SCHEMBL11020710 0.87 AKR1C3 (0.62) MPOAKR1C3AKR1C2DHODHMEN1
SCHEMBL9515604 0.86 GRIK1 (0.69) AKR1C3AKR1C2MEN1GFERKMT2A
SCHEMBL11603203 0.86 FABP4 (0.69) MPOAKR1C3AKR1C2DHODHMEN1
SCHEMBL14598921 0.86 MAPT (0.65) MPOAKR1C3AKR1C2DHODHMEN1
SCHEMBL10836320 0.85 GRIK1 (0.59) MPOAKR1C3AKR1C2DHODHMEN1
SCHEMBL28741324 0.85 MPO (0.70) MPOAKR1C3AKR1C2DHODHMEN1

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
EP-0186367-B1 ACIDIC INDOLE COMPOUNDS AND THEIR USE AS ANTIALLERGY AGENTS WARNER-LAMBERT COMPANY (US) 1993-03-03 EP disclosed
US-4675332-A Acidic tetrazolyl substituted indole compounds and their use as antiallergy agents WARNER-LAMBERT COMPANY (US) 1987-06-23 US disclosed
CN-85109061-A The preparation method of novel acid benzazolyl compounds 1987-01-21 CN disclosed
EP-0186367-A2 Acidic indole compounds and their use as antiallergy agents WARNER-LAMBERT COMPANY (US) 1986-07-02 EP disclosed