SCHEMBL9636693

SCHEMBL9636693

CSC1=Nc2ccccc2SC(C)C1C

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.35
RAB9A P51151 3/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
NPC1 O15118 2/20 0.35
TDP1 Q9NUW8 2/20 0.35
KDM4E B2RXH2 2/20 0.35
ALDH1A1 P00352 2/20 0.35
HPGD P15428 2/20 0.35
ALOX15 P16050 1/20 0.35
TSHR P16473 1/20 0.35
HSD17B10 Q99714 1/20 0.35
PKM P14618 1/20 0.33
BCHE P06276 5/20 0.32
MEN1 O00255 3/20 0.31
KMT2A Q03164 3/20 0.31
ALOX12 P18054 2/20 0.31
TP53 P04637 1/20 0.31
ACHE P22303 4/20 0.31
LMNA P02545 2/20 0.30
SLC2A1 P11166 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
SCHEMBL9635267 0.83 MAPT (0.36) MAPTRAB9ASMN1; SMN2NPC1TDP1
SCHEMBL9635214 0.75 BCHE (0.40) MAPTRAB9ASMN1; SMN2NPC1TDP1
SCHEMBL9636638 0.74 NOS1 (0.38) MAPTRAB9ASMN1; SMN2NPC1TDP1
SCHEMBL9635260 0.73 MAPT (0.37) MAPTRAB9ASMN1; SMN2NPC1TDP1
SCHEMBL9635262 0.73 MAPT (0.37) MAPTRAB9ASMN1; SMN2NPC1TDP1
SCHEMBL9513943 0.72 MAPT (0.40) MAPTRAB9ASMN1; SMN2NPC1TDP1
SCHEMBL9636615 0.71 MAPT (0.45) MAPTRAB9ASMN1; SMN2NPC1TDP1
SCHEMBL9635057 0.71 NOS1 (0.38) MAPTRAB9ASMN1; SMN2NPC1TDP1
SCHEMBL9635250 0.69 MEN1 (0.40) MAPTRAB9ASMN1; SMN2NPC1TDP1
SCHEMBL9635278 0.67 RAB9A (0.34) MAPTRAB9ASMN1; SMN2NPC1TDP1

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
EP-0368063-B1 PROCESS FOR THE CHLORINATION IN THE NUCLEUS OF AROMATIC HYDROCARBONS BAYER AG (DE) 1992-06-10 EP disclosed
US-4990707-A Process for the ring chlorination of aromatic hydrocarbons BAYER AKTIENGESELLSCHAFT (DE) 1991-02-05 US disclosed