SCHEMBL10557447

SCHEMBL10557447

NC(c1cccnc1)c1ccc(Cl)cc1Cl

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CYP19A1 P11511 1/20 0.50
▸ LMNA P02545 1/20 0.46
▸ TP53 P04637 1/20 0.46
▸ HTT P42858 1/20 0.46
▸ IDO1 P14902 2/20 0.44
▸ TDO2 P48775 1/20 0.44
▸ SLC6A4 P31645 3/20 0.43
▸ SLC6A3 Q01959 2/20 0.43
▸ MEN1 O00255 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ CYP3A4 P08684 4/20 0.41
▸ CYP3A5 P20815 4/20 0.41
▸ SLC6A2 P23975 2/20 0.41
▸ KCNA5 P22460 2/20 0.40
▸ CFTR P13569 1/20 0.40
▸ GOPC Q9HD26 1/20 0.40
▸ KCND3 Q9UK17 1/20 0.39
▸ HDAC8 Q9BY41 1/20 0.39

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
SCHEMBL10559380 0.85 CYP19A1 (0.41) CYP19A1SLC6A4SLC6A3MAPTSLC6A2
SCHEMBL10556268 0.85 CYP19A1 (0.47) CYP19A1SLC6A4SLC6A3CYP3A4CYP3A5
SCHEMBL10968603 0.83 CYP19A1 (0.51) CYP19A1LMNATP53HTTIDO1
SCHEMBL10562484 0.81 ALPL (0.45) CYP19A1SLC6A4SLC6A3MEN1MAPT
SCHEMBL10967991 0.81 SMN1; SMN2 (0.53) CYP19A1LMNAIDO1TDO2SLC6A4
Hydrochloric Acid SCHEMBL11192967 0.81 CYP19A1 (0.50) CYP19A1LMNAIDO1TDO2SLC6A4
SCHEMBL2010111 0.80 IDO1 (0.60) LMNATP53HTTIDO1TDO2
SCHEMBL3832267 0.78 CYP19A1 (0.68) CYP19A1SLC6A4SLC6A3CYP3A4CYP3A5
SCHEMBL10688955 0.78 CYP19A1 (0.46) CYP19A1LMNATP53HTTIDO1
SCHEMBL3652018 0.78 CYP19A1 (0.46) CYP19A1LMNAIDO1TDO2SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4874775-A INHIBIT PHYTOPATHOGENS ELI LILLY AND COMPANY (US) 1989-10-17 — — US disclosed
EP-0206581-A2 Agriculturally-useful sulfonamides ELI LILLY AND COMPANY (US) 1986-12-30 — — EP disclosed
CN-86103621-A The method of the sulphonamide of preparation agriculturally useful — 1986-12-10 — — CN disclosed
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