SCHEMBL28394458

SCHEMBL28394458

CC1CCCCN1NC(O)=S.NC(O)=S

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.36
GAA P10253 2/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
KMT2A Q03164 1/20 0.33
MGLL Q99685 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.31
POLB P06746 1/20 0.31
HPGD P15428 1/20 0.31
ALDH1A1 P00352 1/20 0.31
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA7 P43166 1/20 0.31
CA9 Q16790 1/20 0.31
CA14 Q9ULX7 1/20 0.31
MAPT P10636 1/20 0.30
LMNA P02545 1/20 0.30
GFER P55789 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
SCHEMBL8723669 0.94 HTT (0.39) HTTGAANPC1RAB9ANPSR1
N-Methylpiperidine SCHEMBL28912564 0.92 HTT (0.33) HTTGAANPC1RAB9ANPSR1
SCHEMBL10782714 0.72 HPGD (0.33) HTTGAANPC1RAB9ANPSR1
SCHEMBL28460820 0.71 HTT (0.43) HTTGAANPC1RAB9ANPSR1
SCHEMBL6336369 0.70 ALDH1A1 (0.41) GAAKMT2APOLBHPGDALDH1A1
SCHEMBL6017514 0.70
SCHEMBL7515932 0.68 KMT2A (0.53) GAANPC1RAB9ANPSR1KMT2A
SCHEMBL8718776 0.68 PHGDH (0.39) HTTGAANPC1RAB9AMGLL
SCHEMBL9222113 0.68
SCHEMBL3066005 0.68 HTT (0.35) HTTHPGDALDH1A1CA12CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110291148-B Rubber composition for conveyor belt, method for producing rubber composition for conveyor belt, and belt conveyor 横滨橡胶株式会社 2022-06-21 CN disclosed
CN-110291147-B Rubber composition for conveyor belt, method for producing rubber composition for conveyor belt, and belt conveyor 横滨橡胶株式会社 2021-11-12 CN disclosed
CN-107709411-B Composition for optical material and optical material 三菱瓦斯化学株式会社 2020-05-12 CN disclosed