SCHEMBL1933693

SCHEMBL1933693

N[S+]([O-])c1nc2c(C3CCCCC3)cccc2s1

nearest known ligand 0.32

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TDO2 P48775 1/20 0.32
HPGD P15428 2/20 0.32
ALDH1A1 P00352 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
CASP3 P42574 2/20 0.31
SENP7 Q9BQF6 2/20 0.31
SENP6 Q9GZR1 2/20 0.31
POLB P06746 1/20 0.31
CNR1 P21554 1/20 0.31
CNR2 P34972 1/20 0.31
RAB9A P51151 2/20 0.30
SMN1; SMN2 Q16637 2/20 0.30
NPC1 O15118 1/20 0.30
TSHR P16473 1/20 0.30
SENP8 Q96LD8 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
SCHEMBL27528566 0.85 TDO2 (0.31) TDO2
SCHEMBL27626936 0.79 LMNA (0.50) TDO2ALDH1A1TDP1POLBSMN1; SMN2
SCHEMBL20305613 0.79 LMNA (0.50) TDO2ALDH1A1TDP1POLBSMN1; SMN2
SCHEMBL4673792 0.77 KMT2A (0.42) HPGDALDH1A1TDP1CASP3SENP7
SCHEMBL333081 0.76 KMT2A (0.39) HPGDALDH1A1CASP3SENP7SENP6
SCHEMBL357736 0.75 TXN (0.39) TDO2HPGDALDH1A1TDP1CASP3
SCHEMBL540891 0.74 CA2 (0.48)
SCHEMBL27656831 0.74 ALDH1A1 (0.43) HPGDALDH1A1TDP1CNR1RAB9A
SCHEMBL28471930 0.73 KMT2A (0.37) ALDH1A1POLBCNR1CNR2SMN1; SMN2
SCHEMBL27474569 0.73 KMT2A (0.37) HPGDALDH1A1TDP1POLBCNR1

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-11667771-B2 Elastomeric article TOP GLOVE INTERNATIONAL SDN. BHD. (MY) 2023-06-06 US claimed
CN-113454153-B In-line ultrasonic inspection for detecting partial vulcanization of rubber mixtures in-situ silylation of light-colored fillers 朗盛德国有限责任公司 2023-04-28 CN disclosed
CN-104470971-A Energy ray-curable resin composition and cured product thereof NIPPON KAYAKU KK 2015-03-25 CN disclosed
EP-2507313-A1 ELASTOMERIC RUBBER AND RUBBER PRODUCTS WITHOUT THE USE OF VULCANIZING ACCELERATORS AND SULFUR Kossan SDN BHD (MY) 2012-10-10 EP disclosed
WO-2011068394-A1 ELASTOMERIC RUBBER AND RUBBER PRODUCTS WITHOUT THE USE OF VULCANIZING ACCELERATORS AND SULFUR KOSSAN SDN BHD (MY) 2011-06-09 WO disclosed