SCHEMBL13620989

SCHEMBL13620989

c1ccc2cc(-c3ccc(-c4c5ccccc5c(-c5ccc(-c6nc7ccccc7o6)cc5)c5ccccc45)cc3)ccc2c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 9/20 0.54
RAB9A P51151 7/20 0.54
MEN1 O00255 3/20 0.54
KMT2A Q03164 3/20 0.54
ATM Q13315 1/20 0.54
ALDH1A1 P00352 7/20 0.50
HPGD P15428 6/20 0.50
HSD17B10 Q99714 5/20 0.50
KDM4E B2RXH2 5/20 0.50
SMN1; SMN2 Q16637 4/20 0.50
TP53 P04637 3/20 0.50
MMP2 P08253 1/20 0.48
MMP9 P14780 1/20 0.48
MMP8 P22894 1/20 0.48
MMP13 P45452 1/20 0.48
MAPT P10636 4/20 0.48
HCRTR1 O43613 2/20 0.48
PKM P14618 1/20 0.48
UTRN P46939 4/20 0.46
CYP1A2 P05177 1/20 0.46

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
SCHEMBL4355625 0.96 NPC1 (0.55) NPC1RAB9AMEN1KMT2AATM
SCHEMBL12322691 0.95 NPC1 (0.49) NPC1RAB9AMEN1KMT2AATM
SCHEMBL11953884 0.93 NPC1 (0.50) NPC1RAB9AMEN1KMT2AATM
SCHEMBL13620988 0.93 NPC1 (0.50) NPC1RAB9AMEN1KMT2AATM
SCHEMBL12571621 0.92 NPC1 (0.51) NPC1RAB9AMEN1KMT2AATM
SCHEMBL19846119 0.91 NPC1 (0.63) NPC1RAB9AMEN1KMT2AATM
SCHEMBL12571626 0.90 NPC1 (0.47) NPC1RAB9AMEN1KMT2AATM
SCHEMBL13645858 0.90 NPC1 (0.58) NPC1RAB9AMEN1KMT2AATM
SCHEMBL24038390 0.90 PTPN2 (0.50) NPC1RAB9AMEN1KMT2AATM
SCHEMBL13620987 0.90 NPC1 (0.49) NPC1RAB9AMEN1KMT2AATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8859108-B2 Benzoxazole derivative, and light-emitting element, light-emitting device, and electronic device using the same SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2014-10-14 US disclosed
US-8859108-B2 Benzoxazole derivative, and light-emitting element, light-emitting device, and electronic device using the same SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2014-10-14 US disclosed
US-20090286985-A1 Benzoxazole Derivative, and Light-Emitting Element, Light-Emitting Device, and Electronic Device Using the Same SEMICONDUCTOR ENERGY LABARATORY CO., LTD. 2009-11-19 US disclosed
US-20090286985-A1 Benzoxazole Derivative, and Light-Emitting Element, Light-Emitting Device, and Electronic Device Using the Same SEMICONDUCTOR ENERGY LABARATORY CO., LTD. 2009-11-19 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090286985-A1 Benzoxazole Derivative, and Light-Emitting Element, Light-Emitting Device, and Electronic Device Using the Same CYP4X1, XDH, GABRA5 NPC1 3482/4885RAB9A 3100/4885MEN1 2966/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.