SCHEMBL12307014

SCHEMBL12307014

Cc1ccc(-c2ccc(-c3ccc(-c4ccc(C)s4)cc3)s2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 9/20 0.46
ESR1 P03372 2/20 0.46
ESR2 Q92731 2/20 0.46
HSD17B1 P14061 2/20 0.46
HSD17B2 P37059 2/20 0.46
PGR P06401 1/20 0.42
ALDH1A1 P00352 3/20 0.41
HSD17B10 Q99714 2/20 0.41
LMNA P02545 2/20 0.41
NPC1 O15118 1/20 0.41
MAPT P10636 1/20 0.41
GFER P55789 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ESRRG P62508 1/20 0.40
KDM4E B2RXH2 1/20 0.40
GAA P10253 1/20 0.40
HPGD P15428 1/20 0.40
ALOX15 P16050 1/20 0.40
ALOX12 P18054 1/20 0.40
APOBEC3G Q9HC16 1/20 0.40

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
SCHEMBL10016215 0.98 APP (0.45) APPESR1ESR2HSD17B1HSD17B2
SCHEMBL147842 0.98 HSD17B1 (0.44) APPESR1ESR2HSD17B1HSD17B2
SCHEMBL15599289 0.95 HSD17B1 (0.43) APPESR1ESR2HSD17B1HSD17B2
SCHEMBL13376691 0.90 APP (0.50) APPESR1ESR2HSD17B1HSD17B2
SCHEMBL9927249 0.90 APP (0.48) APPESR1ESR2HSD17B1HSD17B2
SCHEMBL9968693 0.90 APP (0.55) APPESR1ESR2HSD17B1HSD17B2
SCHEMBL13424304 0.87 APP (0.46) APPESR1ESR2HSD17B1HSD17B2
SCHEMBL10300218 0.87 APP (0.46) APPESR1ESR2HSD17B1HSD17B2
SCHEMBL12575567 0.87 APP (0.52) APPESR1ESR2HSD17B1HSD17B2
SCHEMBL12125122 0.86 HSD17B1 (0.49) APPHSD17B1HSD17B2PGRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9424998-B2 Dye, photoelectric conversion element using the same, photoelectrochemical cell, and method of producing dye FUJIFILM CORPORATION (JP) 2016-08-23 US disclosed
US-9424998-B2 Dye, photoelectric conversion element using the same, photoelectrochemical cell, and method of producing dye FUJIFILM CORPORATION (JP) 2016-08-23 US disclosed
EP-2845882-A2 Dye, Photoelectric Conversion Element and Photoelectrochemical Cell Fujifilm Corporation (JP) 2015-03-11 EP disclosed
US-8779126-B2 Dye, photoelectric conversion element using the same, photoelectrochemical cell, and method of producing dye FUJIFILM CORPORATION (JP) 2014-07-15 US disclosed
US-8779126-B2 Dye, photoelectric conversion element using the same, photoelectrochemical cell, and method of producing dye FUJIFILM CORPORATION (JP) 2014-07-15 US disclosed
US-20110213144-A1 DYE, PHOTOELECTRIC CONVERSION ELEMENT USING THE SAME, PHOTOELECTROCHEMICAL CELL, AND METHOD OF PRODUCING DYE FUJIFILM CORPORATION (JP) 2011-09-01 US disclosed
US-20110213144-A1 DYE, PHOTOELECTRIC CONVERSION ELEMENT USING THE SAME, PHOTOELECTROCHEMICAL CELL, AND METHOD OF PRODUCING DYE FUJIFILM CORPORATION (JP) 2011-09-01 US disclosed
US-20070287848-A1 Silicon Compound Containi-Electron Conjugated-System Molecule and Process for Producing the Same SHARP KABUSHIKI KAISHA (JP) 2007-12-13 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 (2 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-20070287848-A1 Silicon Compound Containi-Electron Conjugated-System Molecule and Process for Producing the Same SEM1, F12, ESPL1 APP 1094/4885ESR1 9/4885ESR2 439/4885
US-20110213144-A1 DYE, PHOTOELECTRIC CONVERSION ELEMENT USING THE SAME, PHOTOELECTROCHEMICAL CELL, AND METHOD OF PRODUCING DYE CYBA, SCN3A, CRY1 APP 1812/4885ESR1 620/4885ESR2 1680/4885

“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.