SCHEMBL714890

SCHEMBL714890

[c]1ccccc1-c1cc(-c2ccccc2)sn1

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.33
NPC1 O15118 1/20 0.33
ASIC3 Q9UHC3 2/20 0.33
ADORA2A P29274 1/20 0.33
ADORA1 P30542 1/20 0.33
CYP11B1 P15538 2/20 0.32
CYP11B2 P19099 2/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
PSMB8 P28062 1/20 0.31

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
SCHEMBL28510819 0.78 RAB9A (0.46) RAB9ANPC1ASIC3ADORA2AADORA1
SCHEMBL714891 0.76 ASIC3 (0.38) RAB9ANPC1ASIC3ADORA2AADORA1
SCHEMBL715045 0.72 MEN1 (0.61) RAB9ANPC1ASIC3ADORA2AADORA1
SCHEMBL715959 0.71 RAB9A (0.65) RAB9ANPC1MEN1KMT2A
SCHEMBL714896 0.69 HSD17B1 (0.46) RAB9ANPC1MEN1KMT2A
SCHEMBL715745 0.69 RAB9A (0.44) RAB9ANPC1CYP11B1CYP11B2MEN1
SCHEMBL28511914 0.69 NPC1 (0.46) RAB9ANPC1ADORA2AADORA1
SCHEMBL28906122 0.69 NPC1 (0.51) RAB9ANPC1ADORA2AADORA1MEN1
SCHEMBL714570 0.69 ASIC3 (0.50) RAB9ANPC1ASIC3ADORA2AADORA1
SCHEMBL28501588 0.69 NPC1 (0.51) RAB9ANPC1ADORA2AADORA1MEN1

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-8771843-B2 Fluorene derivative, organic compound, and light-emitting element, light-emitting device, and electronic device using the compound SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2014-07-08 US disclosed
US-20120049768-A1 Fluorene Derivative, Organic Compound, and Light-Emitting Element, Light-Emitting Device, and Electronic Device Using the Compound SEMICONDUCTOR ENERGY LABORATORY CO., LTD. 2012-03-01 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-20120049768-A1 Fluorene Derivative, Organic Compound, and Light-Emitting Element, Light-Emitting Device, and Electronic Device Using the Compound AFF2, MAPRE2, AFF4 RAB9A 440/4885NPC1 2154/4885ASIC3 650/4885

“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.