SCHEMBL17022757

SCHEMBL17022757

O=c1c2ccccc2cnn1Cc1nnc(S)[nH]1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.51
SMN1; SMN2 Q16637 2/20 0.48
KDM4E B2RXH2 2/20 0.48
NPC1 O15118 4/20 0.47
RAB9A P51151 4/20 0.47
PKM P14618 2/20 0.47
MITF O75030 1/20 0.47
POLB P06746 4/20 0.46
RXFP1 Q9HBX9 3/20 0.46
ALDH1A1 P00352 3/20 0.45
APOBEC3G Q9HC16 1/20 0.45
HPGD P15428 1/20 0.45
LMNA P02545 1/20 0.45
MAPT P10636 1/20 0.45
MAOB P27338 1/20 0.41
PAX8 Q06710 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL29565549 1.00 TDP1 (0.51) TDP1SMN1; SMN2KDM4ENPC1RAB9A
SCHEMBL29703247 0.75 TDP1 (0.72) TDP1SMN1; SMN2KDM4ENPC1RAB9A
SCHEMBL9027681 0.75 TDP1 (0.72) TDP1SMN1; SMN2KDM4ENPC1RAB9A
Hydrochloric Acid SCHEMBL30088832 0.74 TDP1 (0.70) TDP1SMN1; SMN2KDM4ENPC1RAB9A
SCHEMBL11611242 0.71 NPC1 (0.57) TDP1SMN1; SMN2KDM4ENPC1RAB9A
SCHEMBL10940866 0.71 NPC1 (0.57) TDP1SMN1; SMN2KDM4ENPC1RAB9A
SCHEMBL29735170 0.71 NPC1 (0.57) TDP1SMN1; SMN2KDM4ENPC1RAB9A
SCHEMBL29703239 0.70 TDP1 (0.69) TDP1SMN1; SMN2KDM4ENPC1RAB9A
SCHEMBL7894526 0.70 TDP1 (0.69) TDP1SMN1; SMN2KDM4ENPC1RAB9A
SCHEMBL6216387 0.70 NPC1 (0.64) TDP1SMN1; SMN2KDM4ENPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10557210-B2 Direct electrochemical synthesis of doped conductive polymers on metal alloys THE BOEING COMPANY (US) 2020-02-11 US disclosed
EP-3396028-A2 DIRECT ELECTROCHEMICAL SYNTHESIS OF DOPED CONDUCTIVE POLYMERS ON METAL ALLOYS The Boeing Company (US) 2018-10-31 EP disclosed
EP-2910668-B1 Direct electrochemical synthesis of doped conductive polymers on metal alloys BOEING CO (US) 2018-04-11 EP disclosed
US-20150240378-A1 DIRECT ELECTROCHEMICAL SYNTHESIS OF DOPED CONDUCTIVE POLYMERS ON METAL ALLOYS THE BOEING COMPANY (US) 2015-08-27 US disclosed
EP-2910668-A2 Direct electrochemical synthesis of doped conductive polymers on metal alloys The Boeing Company (US) 2015-08-26 EP disclosed