SCHEMBL17309673

SCHEMBL17309673

O=C(CSSCC(=O)NCc1nc2ccccc2[nH]1)NCc1nc2ccccc2[nH]1

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.59
POLB P06746 2/20 0.59
RAB9A P51151 2/20 0.59
SMN1; SMN2 Q16637 2/20 0.57
TSHR P16473 2/20 0.57
MAPK10 P53779 2/20 0.57
KDM4E B2RXH2 3/20 0.55
ALDH1A1 P00352 2/20 0.55
KMT2A Q03164 1/20 0.55
MAPT P10636 2/20 0.54
PKM P14618 1/20 0.54
HTT P42858 2/20 0.53
GAA P10253 1/20 0.52

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
SCHEMBL17309683 0.86 LMNA (0.57) LMNAPOLBRAB9ASMN1; SMN2TSHR
SCHEMBL1386409 0.85 LMNA (0.62) LMNAPOLBRAB9ASMN1; SMN2TSHR
SCHEMBL1386414 0.85 LMNA (0.62) LMNAPOLBRAB9ASMN1; SMN2TSHR
SCHEMBL17309691 0.85 SMN1; SMN2 (0.57) LMNAPOLBRAB9ASMN1; SMN2TSHR
SCHEMBL12201106 0.84 SMN1; SMN2 (0.75) LMNAPOLBRAB9ASMN1; SMN2TSHR
SCHEMBL8288446 0.84 LMNA (0.60) LMNAPOLBRAB9ASMN1; SMN2TSHR
SCHEMBL305355 0.82 POLB (0.64) LMNAPOLBRAB9ASMN1; SMN2TSHR
SCHEMBL8278816 0.82 SMN1; SMN2 (0.60) LMNAPOLBRAB9ASMN1; SMN2TSHR
SCHEMBL7977173 0.81 POLB (0.63) LMNAPOLBRAB9ASMN1; SMN2TSHR
SCHEMBL3915446 0.81 POLB (0.63) LMNAPOLBRAB9ASMN1; SMN2TSHR

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
US-9546232-B2 Rubber composition, and pneumatic tire using same BRIDGESTONE CORPORATION (JP) 2017-01-17 US disclosed
US-20150353657-A1 RUBBER COMPOSITION, AND PNEUMATIC TIRE USING SAME OTSUKA CHEMICAL CO., LTD. (JP) 2015-12-10 US disclosed
EP-2952541-A1 RUBBER COMPOSITION, AND PNEUMATIC TIRE USING SAME Bridgestone Corporation (JP) 2015-12-09 EP disclosed