SCHEMBL11540445

SCHEMBL11540445

CNC(=O)N(S)c1c(Cl)cccc1Cl

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.42
TP53 P04637 1/20 0.38
ALDH1A1 P00352 2/20 0.36
DOT1L Q8TEK3 1/20 0.36
MAPT P10636 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
TYK2 P29597 1/20 0.34
POLB P06746 1/20 0.33
TSHR P16473 1/20 0.33
MEN1 O00255 1/20 0.33
GAA P10253 1/20 0.33
FEN1 P39748 1/20 0.33

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 0.90 KMT2A (0.39) KMT2ATP53MAPTTYK2GAA
SCHEMBL11364508 0.82 ATM (0.36) KMT2AALDH1A1MAPTTYK2POLB
SCHEMBL11541965 0.81 AKR1C4 (0.36) ALDH1A1TSHR
SCHEMBL11541466 0.81 TSHR (0.38) KMT2AALDH1A1MAPTTSHRMEN1
SCHEMBL11542282 0.80 ALDH1A1 (0.38) KMT2AALDH1A1L3MBTL1POLBMEN1
SCHEMBL11542649 0.80 MAPT (0.41) KMT2AALDH1A1MAPTPOLBTSHR
SCHEMBL11514546 0.79 NPC1 (0.34) KMT2AALDH1A1MAPTL3MBTL1MEN1
SCHEMBL11367097 0.78 ALDH1A1 (0.42) KMT2AALDH1A1TYK2POLBTSHR
SCHEMBL11513960 0.76 GABRA1 (0.41) KMT2ATP53ALDH1A1TSHRMEN1
SCHEMBL11849641 0.76 HPGD (0.41) KMT2ATP53ALDH1A1MAPTPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4148799-A Process for the preparation of 2-aryliminothiazoline solutions BAYER AKTIENGESELLSCHAFT (DE) 1979-04-10 US disclosed