SCHEMBL2623780

SCHEMBL2623780

CC(C)(C)c1ccc(-c2nnc(-c3ccc(-c4nnc(-c5ccc(C(C)(C)C)cc5)o4)cc3)o2)cc1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 7/20 0.75
RAB9A P51151 7/20 0.75
KDM4E B2RXH2 2/20 0.75
S1PR1 P21453 2/20 0.67
NR1H4 Q96RI1 1/20 0.57
EGFR P00533 1/20 0.55
NOTUM Q6P988 1/20 0.55
TP53 P04637 3/20 0.51
POLB P06746 2/20 0.51
S1PR4 O95977 1/20 0.51
S1PR5 Q9H228 1/20 0.51
SMN1; SMN2 Q16637 2/20 0.50
IKBKB O14920 2/20 0.50
HPGD P15428 2/20 0.50
KIF11 P52732 2/20 0.50
NFKB1 P19838 1/20 0.50
NFKB2 Q00653 1/20 0.50
RELA Q04206 1/20 0.50
MAPT P10636 2/20 0.49
ALDH1A1 P00352 1/20 0.49

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
SCHEMBL3293191 1.00 NPC1 (0.75) NPC1RAB9AKDM4ES1PR1NR1H4
SCHEMBL6296907 0.98 NPC1 (0.72) NPC1RAB9AKDM4ES1PR1NR1H4
SCHEMBL1104799 0.98 NPC1 (0.72) NPC1RAB9AKDM4ES1PR1NR1H4
SCHEMBL460873 0.94 NPC1 (0.68) NPC1RAB9AKDM4ES1PR1NR1H4
SCHEMBL12427246 0.94 NPC1 (0.68) NPC1RAB9AKDM4ES1PR1NR1H4
SCHEMBL10035781 0.92 NPC1 (0.66) NPC1RAB9AKDM4ES1PR1NR1H4
SCHEMBL2839508 0.92 S1PR1 (0.69) NPC1RAB9AKDM4ES1PR1NR1H4
SCHEMBL25408258 0.90 NPC1 (0.70) NPC1RAB9AKDM4ES1PR1NR1H4
SCHEMBL74782 0.90 S1PR1 (0.67) NPC1RAB9AKDM4ES1PR1NR1H4
SCHEMBL46191 0.90 NPC1 (0.64) NPC1RAB9AKDM4ES1PR1NR1H4

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 52 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020130592-A1 METAL HALIDE PEROVSKITE LIGHT EMITTING DEVICE AND METHOD FOR MANUFACTURING SAME 서울대학교산학협력단 2020-06-25 WO disclosed
US-20180148428-A1 ORGANIC LIGHT EMITTING DEVICE WITH THERMALLY ACTIVATED DELAYED FLUORESCENT LIGHT EMITTING MATERIAL COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2018-05-31 US disclosed
US-20180148428-A1 ORGANIC LIGHT EMITTING DEVICE WITH THERMALLY ACTIVATED DELAYED FLUORESCENT LIGHT EMITTING MATERIAL COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2018-05-31 US disclosed
US-9859504-B2 Diamine compounds for phosphorescent diazaborole metal complexes and electroluminescent devices COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2018-01-02 US disclosed
US-9785011-B2 Liquid crystal display having improved wavelength dispersion characteristics AKRON POLYMER SYSTEMS (US) 2017-10-10 US disclosed
US-9768397-B2 Phenylenediamine compounds for phosphorescent diazaborole metal complexes COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2017-09-19 US disclosed
US-9768397-B2 Phenylenediamine compounds for phosphorescent diazaborole metal complexes COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2017-09-19 US disclosed
US-20170194591-A1 ORGANIC LIGHT-EMITTING DIODE (OLED) DISPLAY PANEL, ELECTRONIC DEVICE AND MANUFACTURING METHOD Shanghai Tianma AM-OLED Co., Ltd. (CN) 2017-07-06 US disclosed
EP-2706402-B1 Optical compensation films based on stretched polymer films AKRON POLYMER SYSTEMS (US) 2017-02-01 EP disclosed
US-9520574-B2 Electroluminescent devices based on phosphorescent iridium and related group VIII metal multicyclic compounds COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2016-12-13 US disclosed
US-20080241427-A1 Optical retardation compensation film having positive C-plate and at least one negative C-plate; LCD device; optical switches and waveguides AKRON POLYMER SYSTEMS 2008-10-02 US disclosed
US-20080241428-A1 Optical compensation films with disk groups for liquid crystal display AKRON POLYMER SYSTEMS 2008-10-02 US disclosed
US-20080239491-A1 Optical compensation films having positive birefringence for liquid crystal display AKRON POLYMER SYSTEMS 2008-10-02 US disclosed
US-20080241565-A1 Optical compensation films with birefringence enhancing substituents for liquid crystal display AKRON POLYMER SYSTEMS 2008-10-02 US disclosed
US-20080237552-A1 Optical compensation films with mesogen groups for liquid crystal display AKRON POLYMER SYSTEMS 2008-10-02 US disclosed
US-6908638-B2 Organic electroluminescent element and method of manufacturing same MINOLTA CO., LTD. (JP) 2005-06-21 US disclosed
US-20010033347-A1 Display element and layered type display element MINOLTA CO., LTD. 2001-10-25 US disclosed
US-20010003601-A1 ORGANIC ELECTROLUMINECENT ELEMENT AND METHOD OF MANUFACTURING SAME MINOLTA CO., LTD. (JP) 2001-06-14 US disclosed
US-6180217-B1 Organic electroluminescent element MINOLTA CO., LTD. (JP) 2001-01-30 US disclosed
US-6060826-A Organic electroluminescent element having an excimer light irradiated positive electrode and method of manufacturing the same MINOLTA CO., LTD. (JP) 2000-05-09 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-20180148428-A1 ORGANIC LIGHT EMITTING DEVICE WITH THERMALLY ACTIVATED DELAYED FLUORESCENT LIGHT EMITTING MATERIAL OCIAD1, OCIAD2, TRPA1 NPC1 1416/4885RAB9A 1372/4885KDM4E 4198/4885

“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.