SCHEMBL1726043

SCHEMBL1726043

Fc1ccc(NC(=S)Cc2ccccc2)c(F)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 4/20 0.57
▸ POLB P06746 1/20 0.57
▸ ALDH1A1 P00352 2/20 0.57
▸ SMN1; SMN2 Q16637 4/20 0.51
▸ HTT P42858 3/20 0.51
▸ NPC1 O15118 2/20 0.51
▸ MEN1 O00255 3/20 0.48
▸ KMT2A Q03164 3/20 0.48
▸ LMNA P02545 2/20 0.48
▸ EGFR P00533 1/20 0.47
▸ PKM P14618 1/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ MAPT P10636 2/20 0.46
▸ CA1 P00915 1/20 0.46
▸ CA2 P00918 1/20 0.46
▸ CA5A P35218 1/20 0.46
▸ CA7 P43166 1/20 0.46
▸ CA5B Q9Y2D0 1/20 0.46
▸ CYP1A2 P05177 1/20 0.46
▸ CYP3A4 P08684 1/20 0.46

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
SCHEMBL18826081 0.81 RAB9A (0.74) RAB9APOLBALDH1A1SMN1; SMN2HTT
SCHEMBL31252414 0.81 RAB9A (0.74) RAB9APOLBALDH1A1SMN1; SMN2HTT
SCHEMBL5814377 0.76 HTT (0.54) RAB9APOLBALDH1A1SMN1; SMN2HTT
SCHEMBL16566513 0.74 LMNA (0.72) RAB9AALDH1A1SMN1; SMN2HTTNPC1
SCHEMBL8511541 0.73 HDAC1 (0.49) RAB9AALDH1A1SMN1; SMN2HTTNPC1
SCHEMBL5453503 0.73 HPGD (0.61) RAB9AALDH1A1SMN1; SMN2HTTNPC1
SCHEMBL285633 0.72 RAB9A (0.60) RAB9APOLBALDH1A1SMN1; SMN2HTT
SCHEMBL5203429 0.71 SHMT2 (0.56) RAB9APOLBALDH1A1SMN1; SMN2HTT
SCHEMBL24356073 0.71 HTT (0.56) RAB9APOLBALDH1A1SMN1; SMN2HTT
SCHEMBL20560625 0.71 LMNA (0.53) RAB9AALDH1A1SMN1; SMN2HTTNPC1

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
CN-103140136-B9 Fungicidal pyrazoles and mixtures thereof 杜邦公司 2016-06-29 — — CN disclosed
EP-2403834-A1 Fungicidal pyrazoles E. I. du Pont de Nemours and Company (US) 2012-01-11 — — EP disclosed
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