SCHEMBL21099019

SCHEMBL21099019

NC(CCCCC1CCCCC1)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 2/20 0.47
NPSR1 Q6W5P4 2/20 0.42
KDM1A O60341 1/20 0.41
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41
RECQL P46063 1/20 0.40
ATM Q13315 1/20 0.40
IDO1 P14902 2/20 0.39
CHRM3 P20309 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
MCL1 Q07820 1/20 0.39
CYSLTR2 Q9NS75 1/20 0.38
CYSLTR1 Q9Y271 1/20 0.38
HTR2A P28223 1/20 0.38
HRH1 P35367 1/20 0.38

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
SCHEMBL11680802 0.88 IDO1 (0.42) SIGMAR1KDM1AMAOAMAOBIDO1
SCHEMBL17373052 0.78 SCN4A (0.50) HTR2AHRH1
SCHEMBL9009370 0.78 METAP2 (0.46) IDO1
SCHEMBL28660567 0.78 METAP2 (0.46) IDO1
SCHEMBL12927229 0.78 METAP2 (0.46) IDO1
SCHEMBL28672429 0.78 METAP2 (0.46) IDO1
SCHEMBL7898573 0.78 METAP2 (0.46) IDO1
SCHEMBL6570842 0.77 CYP2D6 (0.47) SIGMAR1KDM1AMAOAMAOBIDO1
Hydrochloric Acid SCHEMBL28350804 0.76 SCN4A (0.48) HTR2AHRH1
Hydrochloric Acid SCHEMBL9009360 0.76 IDO1 (0.46) IDO1

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
EP-3509116-A1 PHOTOELECTRIC CONVERSION ELEMENT AND SOLAR BATTERY FUJIFILM Corporation (JP) 2019-07-10 EP disclosed
US-20190189944-A1 PHOTOELECTRIC CONVERSION ELEMENTS AND SOLAR CELL FUJIFILM CORPORATION (JP) 2019-06-20 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-20190189944-A1 PHOTOELECTRIC CONVERSION ELEMENTS AND SOLAR CELL NR2E3, SCN3A, CRY1 SIGMAR1 2360/4885NPSR1 1252/4885KDM1A 1654/4885

“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.