SCHEMBL7790555

SCHEMBL7790555

O=C(Nc1ccc([S])cc1)c1ccccc1

nearest known ligand 0.71

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 2/20 0.71
NPC1 O15118 8/20 0.69
RAB9A P51151 8/20 0.69
SIRT1 Q96EB6 2/20 0.69
KMT2A Q03164 2/20 0.69
MEN1 O00255 1/20 0.69
KDM4E B2RXH2 1/20 0.69
POLB P06746 1/20 0.69
MAPT P10636 1/20 0.67
SMN1; SMN2 Q16637 1/20 0.67
KCNK3 O14649 1/20 0.66
KCNK9 Q9NPC2 1/20 0.66
CACNA1B Q00975 1/20 0.65
APBA1 Q02410 1/20 0.65
PRMT1 Q99873 1/20 0.62
FFAR1 O14842 1/20 0.62
PGR P06401 1/20 0.62
JAK2 O60674 1/20 0.61
TYK2 P29597 1/20 0.61

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
SCHEMBL126415 0.89 PTPN1 (0.87) PTPN1NPC1RAB9ASIRT1KMT2A
SCHEMBL14715899 0.88 PTPN1 (0.77) PTPN1NPC1RAB9ASIRT1KMT2A
SCHEMBL14715824 0.87 NPC1 (0.88) PTPN1NPC1RAB9ASIRT1KMT2A
SCHEMBL18103163 0.87 NPC1 (0.88) PTPN1NPC1RAB9ASIRT1KMT2A
SCHEMBL14715851 0.86 KMT2A (0.79) PTPN1NPC1RAB9ASIRT1KMT2A
SCHEMBL26953087 0.85 PTPN1 (0.88) PTPN1NPC1RAB9ASIRT1KMT2A
SCHEMBL24202631 0.85 SIRT1 (0.83) PTPN1NPC1RAB9ASIRT1KMT2A
N-Phenylbenzamide SCHEMBL5402750 0.85 SIRT1 (0.83) PTPN1NPC1RAB9ASIRT1KMT2A
N-Phenylbenzamide SCHEMBL31966 0.85 SIRT1 (0.83) PTPN1NPC1RAB9ASIRT1KMT2A
SCHEMBL18330583 0.83 PTPN1 (0.77) PTPN1NPC1RAB9ASIRT1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2700644-B1 NOVEL COMPOUND, NEAR-INFRARED ABSORBENT, AND SYNTHETIC RESIN COMPOSITION CONTAINING SAME ADEKA CORP (JP) 2015-05-20 EP disclosed
EP-2700644-A1 NOVEL COMPOUND, NEAR-INFRARED ABSORBENT, AND SYNTHETIC RESIN COMPOSITION CONTAINING SAME Adeka Corporation (JP) 2014-02-26 EP disclosed
US-8652363-B1 Compound, near-infrared absorber, and synthetic resin composition containing same ADEKA CORPORATION (JP) 2014-02-18 US disclosed
US-20140027685-A1 NOVEL COMPOUND, NEAR-INFRARED ABSORBER, AND SYNTHETIC RESIN COMPOSITION CONTAINING SAME ADEKA CORPORATION (JP) 2014-01-30 US disclosed
EP-1152035-A1 PREFORM FOR HOLLOW MOLDING MADE OF POLYESTER RESIN COMPOSITION, HOLLOW MOLDING MADE OF POLYESTER RESIN COMPOSITION, AND PROCESS FOR PRODUCING THE SAME Mitsui Chemicals, Inc. (JP) 2001-11-07 EP disclosed
EP-0767221-B1 Near infrared ray absorbing compound having high durability and its use MITSUI CHEMICALS INC (JP) 2000-07-05 EP disclosed
US-5788914-A Near infrared ray absorbing compound having high durability and its use MITSUI CHEMICALS, INC. (JP) 1998-08-04 US disclosed
EP-0767221-A1 Near infrared ray absorbing compound having high durability and its use MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1997-04-09 EP disclosed