SCHEMBL23716379

SCHEMBL23716379

C/C(Cl)=C\C=C(/N)Cc1ccc(C)cc1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 3/20 0.38
L3MBTL1 Q9Y468 4/20 0.38
NPC1 O15118 4/20 0.38
RAB9A P51151 4/20 0.38
SMN1; SMN2 Q16637 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
MAPT P10636 2/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2A6 P11509 1/20 0.35
TAAR1 Q96RJ0 1/20 0.35
CTBP2 P56545 1/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
KMT2A Q03164 1/20 0.35
AGXT P21549 1/20 0.34
MAPK8 P45983 1/20 0.34
LMNA P02545 1/20 0.34
CA2 P00918 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
SCHEMBL23716034 0.86 IDO1 (0.38) IDO1L3MBTL1NPC1RAB9ASMN1; SMN2
SCHEMBL23715988 0.85 IDO1 (0.40) IDO1L3MBTL1NPC1RAB9AMAPT
SCHEMBL23716046 0.82 IDO1 (0.38) IDO1L3MBTL1NPC1RAB9ASMN1; SMN2
SCHEMBL23716382 0.80 LOXL2 (0.42) IDO1L3MBTL1NPC1RAB9ASMN1; SMN2
SCHEMBL23715869 0.79 SMN1; SMN2 (0.33) IDO1L3MBTL1SMN1; SMN2ALDH1A1KMT2A
SCHEMBL23715862 0.78 IDO1 (0.41) IDO1TAAR1KMT2ALMNA
SCHEMBL23716112 0.76 PIK3CA (0.43) IDO1NPC1RAB9ASMN1; SMN2MEN1
SCHEMBL23716287 0.74 ANO1 (0.34) MAPTTAAR1
SCHEMBL23716362 0.73 IDO1 (0.39) IDO1L3MBTL1NPC1RAB9ASMN1; SMN2
SCHEMBL23715945 0.71 IDO1 (0.35) IDO1L3MBTL1NPC1RAB9ASMN1; SMN2

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
EP-3209732-B1 SPHINGOSINE-1-PHOSPATE RECEPTOR MODULATORS FOR TREATMENT OF CARDIOPULMONARY DISORDERS SCRIPPS RESEARCH INST (US) 2021-08-04 EP disclosed