SCHEMBL15975640

SCHEMBL15975640

C=CCN(C(=O)[C@@H](C)CSC)c1cn(-c2cccnc2)nc1Cl

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.32
ALDH1A1 P00352 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
MAPK1 P28482 1/20 0.30

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
SCHEMBL4968544 1.00 LMNA (0.32) LMNAALDH1A1NPC1RAB9AMAPK1
SCHEMBL15363425 1.00 LMNA (0.32) LMNAALDH1A1NPC1RAB9AMAPK1
SCHEMBL15356674 0.90 NPC1 (0.33) LMNANPC1RAB9AMAPK1
SCHEMBL15975595 0.90 NPC1 (0.33) LMNANPC1RAB9AMAPK1
SCHEMBL10278832 0.90 NPC1 (0.33) LMNANPC1RAB9AMAPK1
SCHEMBL4970017 0.89 NPC1 (0.33) LMNAALDH1A1NPC1RAB9AMAPK1
SCHEMBL10236114 0.89 ALDH1A1 (0.34) LMNAALDH1A1NPC1RAB9AMAPK1
SCHEMBL15356966 0.88 ALDH1A1 (0.32) LMNAALDH1A1NPC1RAB9AMAPK1
SCHEMBL15975723 0.87 RECQL (0.36) LMNAALDH1A1NPC1RAB9AMAPK1
SCHEMBL2692541 0.87 ALDH1A1 (0.32) LMNAALDH1A1NPC1RAB9AMAPK1

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-8815271-B2 Pesticidal compositions and processes related thereto DOW AGROSCIENCES, LLC. (US) 2014-08-26 US disclosed
US-8815271-B2 Pesticidal compositions and processes related thereto DOW AGROSCIENCES, LLC. (US) 2014-08-26 US disclosed