SCHEMBL11514546

SCHEMBL11514546

CNC(=O)N(S)c1c(C)cccc1C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
ALDH1A1 P00352 5/20 0.34
LMNA P02545 2/20 0.34
MAPT P10636 2/20 0.34
SCN4A P35499 2/20 0.34
CYP3A4 P08684 1/20 0.34
MAPK1 P28482 1/20 0.34
MC4R P32245 1/20 0.34
MC3R P41968 1/20 0.34
HTR3A P46098 1/20 0.34
SCN5A Q14524 1/20 0.34
SCN9A Q15858 1/20 0.34
SCN3A Q9NY46 1/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
PLA2G1B P04054 1/20 0.34
HTT P42858 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
ATG4B Q9Y4P1 1/20 0.34

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
SCHEMBL11542709 0.88 KMT2A (0.39) MAPTKMT2ANPSR1GAA
SCHEMBL11542860 0.87 ALDH1A1 (0.45) ALDH1A1LMNAMAPTSCN4ACYP3A4
SCHEMBL11541578 0.83 NCEH1 (0.33)
SCHEMBL11511412 0.82 ALDH1A1 (0.46) ALDH1A1LMNAMAPTMEN1KMT2A
SCHEMBL11548288 0.80 ALDH1A1 (0.39) NPC1RAB9AALDH1A1LMNAMAPT
SCHEMBL11540445 0.79 KMT2A (0.42) ALDH1A1MAPTMEN1KMT2AGAA
SCHEMBL11541431 0.79 TP53 (0.39) NPC1RAB9AALDH1A1LMNACYP3A4
SCHEMBL11513960 0.78 GABRA1 (0.41) ALDH1A1CYP3A4SCN5AMEN1KMT2A
SCHEMBL11542387 0.78 TAS1R3 (0.33) NPC1RAB9AALDH1A1LMNAMAPT
SCHEMBL11174076 0.76 MYC (0.36) ALDH1A1MAPTSCN4ACYP3A4MAPK1

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-4173645-A INSECTICIDES, MITICIDES BAYER AKTIENGESELLSCHAFT (DE) 1979-11-06 US disclosed
US-4148799-A Process for the preparation of 2-aryliminothiazoline solutions BAYER AKTIENGESELLSCHAFT (DE) 1979-04-10 US disclosed