SCHEMBL712891

SCHEMBL712891

[c]1ccc(-c2nnc(-c3ccc(-c4ccc5ccccc5c4)cc3)o2)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 7/20 0.62
HPGD P15428 5/20 0.62
ALDH1A1 P00352 5/20 0.62
HSD17B10 Q99714 3/20 0.62
CYP1A2 P05177 2/20 0.62
CYP3A4 P08684 1/20 0.62
CYP2C9 P11712 1/20 0.62
TSHR P16473 1/20 0.62
CA1 P00915 2/20 0.55
CA2 P00918 2/20 0.55
NPC1 O15118 8/20 0.46
RAB9A P51151 8/20 0.46
KDM4E B2RXH2 4/20 0.45
GLA P06280 1/20 0.45
MAPT P10636 1/20 0.45
ALOX15 P16050 1/20 0.45
ESR1 P03372 1/20 0.44
ESR2 Q92731 1/20 0.44
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42

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
SCHEMBL715720 0.95 SMN1; SMN2 (0.69) SMN1; SMN2HPGDALDH1A1HSD17B10CYP1A2
SCHEMBL534028 0.84 ESR1 (0.59) SMN1; SMN2ALDH1A1CYP1A2CA1CA2
SCHEMBL3791696 0.84 ESR1 (0.59) SMN1; SMN2ALDH1A1CYP1A2CA1CA2
SCHEMBL9195816 0.82 SMN1; SMN2 (0.79) SMN1; SMN2HPGDALDH1A1HSD17B10CYP1A2
SCHEMBL27858243 0.82 ESR1 (0.57) SMN1; SMN2ALDH1A1CYP1A2CA1CA2
SCHEMBL712890 0.82 SMN1; SMN2 (0.56) SMN1; SMN2HPGDALDH1A1HSD17B10CYP1A2
SCHEMBL27477472 0.81 SMN1; SMN2 (0.77) SMN1; SMN2HPGDALDH1A1HSD17B10CYP1A2
SCHEMBL13134580 0.81 ALDH1A1 (0.62) SMN1; SMN2HPGDALDH1A1HSD17B10CYP1A2
SCHEMBL713412 0.79 NPC1 (0.74) SMN1; SMN2HPGDALDH1A1HSD17B10TSHR
SCHEMBL25205531 0.79 ESR1 (0.52) SMN1; SMN2ALDH1A1HSD17B10CYP1A2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10243151-B2 Organic semiconductor material and light-emitting element, light-emitting device, lighting system, and electronic device using the same SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2019-03-26 US disclosed
US-20170250352-A1 Organic Semiconductor Material and Light-Emitting Element, Light-Emitting Device, Lighting System, and Electronic Device Using the Same SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2017-08-31 US disclosed
US-9620723-B2 Organic semiconductor material and light-emitting element, light-emitting device, lighting system, and electronic device using the same SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2017-04-11 US disclosed
EP-2321862-B1 ORGANIC SEMICONDUCTOR MATERIAL AND LIGHT-EMITTING ELEMENT, LIGHT-EMITTING DEVICE, LIGHTING SYSTEM, AND ELECTRONIC DEVICE USING THE SAME SEMICONDUCTOR ENERGY LAB (JP) 2014-11-19 EP disclosed
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-20130112961-A1 Organic Semiconductor Material and Light-Emitting Element, Light-Emitting Device, Lighting System, and Electronic Device Using the Same SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2013-05-09 US disclosed
US-8343639-B2 Organic semiconductor material and light-emitting element, light-emitting device, lighting system, and electronic device using the same SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2013-01-01 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
US-20100060155-A1 Organic Semiconductor Material and Light-Emitting Element, Light-Emitting Device, Lighting System, and Electronic Device Using the Same SEMICONDUCTOR ENERGY LABORATORY CO., LTD. 2010-03-11 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 (5 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-10243151-B2 Organic semiconductor material and light-emitting element, light-emitting device, lighting system, and electronic device using the same OXA1L, BECN1, MAP1LC3A SMN1; SMN2 3015/4885HPGD 3815/4885ALDH1A1 832/4885
US-20170250352-A1 Organic Semiconductor Material and Light-Emitting Element, Light-Emitting Device, Lighting System, and Electronic Device Using the Same OXA1L, BECN1, MAP1LC3A SMN1; SMN2 3015/4885HPGD 3815/4885ALDH1A1 832/4885
US-20100060155-A1 Organic Semiconductor Material and Light-Emitting Element, Light-Emitting Device, Lighting System, and Electronic Device Using the Same OXA1L, BECN1, MAP1LC3A SMN1; SMN2 3015/4885HPGD 3815/4885ALDH1A1 832/4885
US-20120049768-A1 Fluorene Derivative, Organic Compound, and Light-Emitting Element, Light-Emitting Device, and Electronic Device Using the Compound AFF2, MAPRE2, AFF4 SMN1; SMN2 4102/4885HPGD 3662/4885ALDH1A1 1391/4885
US-20130112961-A1 Organic Semiconductor Material and Light-Emitting Element, Light-Emitting Device, Lighting System, and Electronic Device Using the Same OXA1L, BECN1, MAP1LC3A SMN1; SMN2 3015/4885HPGD 3815/4885ALDH1A1 832/4885

“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.