SCHEMBL10005378

SCHEMBL10005378

Bn1c(-c2cccc(-c3nc4ccccc4n3B)n2)nc2ccccc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 6/20 0.40
▸ KDM4E B2RXH2 7/20 0.39
▸ NPC1 O15118 5/20 0.39
▸ SMN1; SMN2 Q16637 4/20 0.39
▸ PKM P14618 3/20 0.39
▸ TP53 P04637 2/20 0.39
▸ HSD17B10 Q99714 2/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ TSHR P16473 1/20 0.39
▸ METAP2 P50579 1/20 0.38
▸ METAP1 P53582 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ PTPN2 P17706 1/20 0.38
▸ PTPN1 P18031 1/20 0.38
▸ ALDH1A1 P00352 6/20 0.38
▸ LMNA P02545 3/20 0.38
▸ GAA P10253 2/20 0.38
▸ HPGD P15428 2/20 0.38

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
SCHEMBL170182 0.86 RAB9A (0.46) RAB9AKDM4ENPC1SMN1; SMN2PKM
SCHEMBL171844 0.84 CTSD (0.52) KDM4ENPC1SMN1; SMN2TP53HSD17B10
SCHEMBL21560939 0.78 KDM4E (0.54) RAB9AKDM4ENPC1SMN1; SMN2PKM
SCHEMBL19820193 0.77 NOS2 (0.55) RAB9AKDM4ENPC1SMN1; SMN2PKM
SCHEMBL29779792 0.77 METAP2 (0.61) RAB9AKDM4ENPC1SMN1; SMN2PKM
SCHEMBL1273984 0.77 METAP2 (0.61) RAB9AKDM4ENPC1SMN1; SMN2PKM
Hydrochloric Acid SCHEMBL7174476 0.74 MEN1 (0.60) RAB9AKDM4ENPC1SMN1; SMN2PKM
SCHEMBL13311160 0.74 MAPK1 (0.61) RAB9AMEN1KMT2ATSHRMAPK1
Hydrochloric Acid SCHEMBL7176548 0.74 MEN1 (0.60) RAB9AKDM4ENPC1SMN1; SMN2PKM
Hydrochloric Acid SCHEMBL7173200 0.74 MEN1 (0.60) RAB9AKDM4ENPC1SMN1; SMN2PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8097361-B2 Nanotube wiring DOW GLOBAL TECHNOLOGIES LLC (US) 2012-01-17 — — US disclosed
US-20100068621-A1 NANOTUBE WIRING DOW GLOBAL TECHNOLOGIES LLC 2010-03-18 — — US disclosed
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