SCHEMBL11657906

SCHEMBL11657906

O=C(SCc1ccc(Cl)cc1)C1CC1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.50
TDP1 Q9NUW8 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
LMNA P02545 3/20 0.45
ALDH1A1 P00352 6/20 0.44
RAB9A P51151 4/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
HPGD P15428 3/20 0.44
NPC1 O15118 3/20 0.44
GAA P10253 2/20 0.42
POLB P06746 1/20 0.41
MAPT P10636 2/20 0.41
HSD11B1 P28845 1/20 0.41
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
NPSR1 Q6W5P4 1/20 0.39

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
SCHEMBL11661930 0.82 IDO1 (0.50) IDO1L3MBTL1ALDH1A1RAB9ASMN1; SMN2
SCHEMBL11656567 0.81 IDO1 (0.53) IDO1L3MBTL1LMNAALDH1A1SMN1; SMN2
SCHEMBL11657752 0.77 IDO1 (0.56) IDO1ALDH1A1POLBMAPTKMT2A
SCHEMBL11654331 0.76 HPGD (0.47) TDP1L3MBTL1LMNAALDH1A1RAB9A
SCHEMBL8345822 0.75 TDP1 (0.62) IDO1TDP1L3MBTL1ALDH1A1RAB9A
SCHEMBL11664604 0.74 SMN1; SMN2 (0.53) IDO1LMNAALDH1A1RAB9ASMN1; SMN2
SCHEMBL11359685 0.73 EPHX1 (0.51) L3MBTL1
Hydrochloric Acid SCHEMBL11842725 0.73 TDP1 (0.61) IDO1TDP1L3MBTL1ALDH1A1RAB9A
SCHEMBL14611678 0.73 IDO1 (0.57) IDO1TDP1L3MBTL1LMNAALDH1A1
SCHEMBL6689595 0.73 IDO1 (0.68) IDO1TDP1L3MBTL1LMNAALDH1A1

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-4112116-A Certain cyclopropane thiolcarboxylates and use thereof as miticides STAUFFER CHEMICAL COMPANY (US) 1978-09-05 US claimed
US-4112116-A Certain cyclopropane thiolcarboxylates and use thereof as miticides STAUFFER CHEMICAL COMPANY (US) 1978-09-05 US disclosed