SCHEMBL223591

SCHEMBL223591

C(=C/Nc1ccccc1)\Nc1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.60
NPC1 O15118 2/20 0.54
RAB9A P51151 2/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
NFKB1 P19838 1/20 0.54
NFKB2 Q00653 1/20 0.54
RELA Q04206 1/20 0.54
NPSR1 Q6W5P4 1/20 0.54
IDO1 P14902 2/20 0.53
TDP1 Q9NUW8 4/20 0.50
HSD17B10 Q99714 3/20 0.50
KMT2A Q03164 2/20 0.50
CTSD P07339 1/20 0.50
TSHR P16473 3/20 0.47
PTGS2 P35354 2/20 0.47
ALOX15 P16050 1/20 0.47
ALOX12 P18054 1/20 0.47
PTGS1 P23219 1/20 0.47
SLC6A2 P23975 1/20 0.47
MAPK1 P28482 1/20 0.47

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
SCHEMBL223592 1.00 ALDH1A1 (0.60) ALDH1A1NPC1RAB9ASMN1; SMN2NFKB1
SCHEMBL13373236 0.87 ALDH1A1 (0.48) ALDH1A1NPC1RAB9ASMN1; SMN2NFKB1
SCHEMBL21264474 0.87 ALDH1A1 (0.48) ALDH1A1NPC1RAB9ASMN1; SMN2NFKB1
SCHEMBL1354066 0.87 ALDH1A1 (0.48) ALDH1A1NPC1RAB9ASMN1; SMN2NFKB1
SCHEMBL17591507 0.87 ALDH1A1 (0.48) ALDH1A1NPC1RAB9ASMN1; SMN2NFKB1
SCHEMBL18779752 0.85 ALDH1A1 (0.52) ALDH1A1NPC1RAB9ASMN1; SMN2NFKB1
SCHEMBL5569513 0.85 ALDH1A1 (0.52) ALDH1A1NPC1RAB9ASMN1; SMN2NFKB1
Benzene SCHEMBL10426584 0.85 ALDH1A1 (0.52) ALDH1A1NPC1RAB9ASMN1; SMN2NFKB1
SCHEMBL6259235 0.85 ALDH1A1 (0.52) ALDH1A1NPC1RAB9ASMN1; SMN2NFKB1
SCHEMBL23467729 0.83 ALDH1A1 (0.50) ALDH1A1NPC1RAB9ASMN1; SMN2NFKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4258123-A UNSATURATED COMPOUND, HALOGENATED TRIAZINE, UNSATURATED KETONE FUJI PHOTO FILM CO., LTD. (JP) 1981-03-24 US claimed
EP-2849563-B1 INSECTICIDAL WATER IN OIL FORMULA BAYER CROPSCIENCE AG (DE) 2020-01-22 EP disclosed
US-10104884-B2 Insecticidal water-in-oil (W/O) formulation BAYER CROPSCIENCE AG (DE) 2018-10-23 US disclosed
CN-104470356-B Water-in-oil (W/O) insecticide formulation 拜尔农作物科学股份公司 2017-10-31 CN disclosed
US-20170197916-A1 FUNCTIONALIZED PEGYLATED CYANINE COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF USE THEREOF BroadPharm (US) 2017-07-13 US disclosed
US-20150098975-A1 INSECTICIDAL WATER-IN-OIL (W/O) FORMULATION DISCOVERY PURCHASER CORPORATION 2015-04-09 US disclosed
CN-104470356-A Water-in-oil (W/O) insecticide formulation BAYER CROPSCIENCE AG 2015-03-25 CN disclosed
US-20120000385-A1 LITHOGRAPHIC PRINTING PLATE MATERIAL AND LITHOGRAPHIC PRINTING PLATE KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2012-01-05 US disclosed
US-20090075201-A1 PLANOGRAPHIC PRINTING PLATE MATERIAL, AND CYCLIC UREIDE MOIETY-CONTAINING PHENOLIC RESIN AND ITS SYNTHETIC PROCESS KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2009-03-19 US disclosed
EP-1498281-B1 Printing method using printing plate KONICA MINOLTA MED & GRAPHIC (JP) 2008-12-03 EP disclosed
US-4769308-A Dry presensitized plate with photosensitive layer containing organotin FUJI PHOTO FILM CO., LTD. (JP) 1988-09-06 US disclosed
EP-0262788-A2 Light-sensitive composition FUJI PHOTO FILM CO., LTD. (JP) 1988-04-06 EP disclosed
US-4701399-A Photosensitive composition with 2-halomethyl-5-substituted-1,3,4-oxadiazole FUJI PHOTO FILM CO., LTD. (JP) 1987-10-20 US disclosed
EP-0118766-A2 Light-sensitive composition KONICA CORPORATION (JP) 1984-09-19 EP disclosed
EP-0115156-A2 Light sensitive composition FUJI PHOTO FILM CO., LTD. (JP) 1984-08-08 EP disclosed
US-4399210-A O-NAPHTHOQUINONEDIAZIDE AND A DISCOLORING AGENT FUJI PHOTO FILM COMPANY LTD. (JP) 1983-08-16 US disclosed
US-4279982-A PRINTOUTS; OXADIAZOLE PHOTOINITIATORS FUJI PHOTO FILM CO., LTD. (JP) 1981-07-21 US disclosed
US-4258123-A UNSATURATED COMPOUND, HALOGENATED TRIAZINE, UNSATURATED KETONE FUJI PHOTO FILM CO., LTD. (JP) 1981-03-24 US disclosed
US-4232106-A Photosensitive compositions containing 2-halomethyl-5-vinyl-1,3,4-oxadiazoles as free radical progenitors FUJI PHOTO FILM CO., LTD. (JP) 1980-11-04 US disclosed
US-3957513-A Method of free radical photography utilizing a short light flash for exposure ASAHI KASEI KOGYO KABUSHIKI KAISHA (JA) 1976-05-18 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-20170197916-A1 FUNCTIONALIZED PEGYLATED CYANINE COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF USE THEREOF ABL1, EGFR, ALB ALDH1A1 1441/4885NPC1 4126/4885RAB9A 420/4885

“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.