SCHEMBL14355174

SCHEMBL14355174

c1ccc(N(c2ccc(C3=C(c4ccc(N(c5ccccc5)c5cccc6ccccc56)cc4)C4CCC3C4)cc2)c2cccc3ccccc23)cc1

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 6/20 0.37
SLC6A3 Q01959 1/20 0.33
TNK2 Q07912 1/20 0.32
KDM4E B2RXH2 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
LTC4S Q16873 1/20 0.32
PTGS2 P35354 1/20 0.31
BCHE P06276 1/20 0.31
ACHE P22303 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
C5AR1 P21730 1/20 0.31
KDM1A O60341 1/20 0.30
SLC6A4 P31645 2/20 0.30
DRD2 P14416 1/20 0.30

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
SCHEMBL29349638 0.82 SIGMAR1 (0.46) SIGMAR1KDM4ECYP1A2CYP3A4CYP2D6
SCHEMBL13854486 0.82 SIGMAR1 (0.46) SIGMAR1KDM4ECYP1A2CYP3A4CYP2D6
SCHEMBL23047 0.82 SIGMAR1 (0.46) SIGMAR1KDM4ECYP1A2CYP3A4CYP2D6
SCHEMBL75887 0.82 SIGMAR1 (0.46) SIGMAR1KDM4ECYP1A2CYP3A4CYP2D6
SCHEMBL6123830 0.82 SIGMAR1 (0.46) SIGMAR1KDM4ECYP1A2CYP3A4CYP2D6
SCHEMBL3463498 0.82 SIGMAR1 (0.46) SIGMAR1KDM4ECYP1A2CYP3A4CYP2D6
SCHEMBL17690821 0.82 SIGMAR1 (0.46) SIGMAR1KDM4ECYP1A2CYP3A4CYP2D6
SCHEMBL15807471 0.82 SIGMAR1 (0.46) SIGMAR1KDM4ECYP1A2CYP3A4CYP2D6
SCHEMBL76513 0.82 SIGMAR1 (0.46) SIGMAR1KDM4ECYP1A2CYP3A4CYP2D6
SCHEMBL6481487 0.82 SIGMAR1 (0.46) SIGMAR1KDM4ECYP1A2CYP3A4CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8481174-B2 Organic light-emitting compound of CIS-diarylethene derivatives, organic electroluminescent device using the same, and method of manufacturing the device SAMSUNG DISPLAY CO., LTD. (KR) 2013-07-09 US disclosed
US-8481174-B2 Organic light-emitting compound of CIS-diarylethene derivatives, organic electroluminescent device using the same, and method of manufacturing the device SAMSUNG DISPLAY CO., LTD. (KR) 2013-07-09 US disclosed
US-20070276160-A1 Organic light-emitting compound of CIS-diarylethene derivatives, organic electroluminescent device using the same, and method of manufacturing the device SAMSUNG DISPLAY CO., LTD. (KR) 2007-11-29 US disclosed
US-20070276160-A1 Organic light-emitting compound of CIS-diarylethene derivatives, organic electroluminescent device using the same, and method of manufacturing the device SAMSUNG DISPLAY CO., LTD. (KR) 2007-11-29 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-20070276160-A1 Organic light-emitting compound of CIS-diarylethene derivatives, organic electroluminescent device using the same, and method of manufacturing the device LEF1, EML4, LAS1L SIGMAR1 4181/4885SLC6A3 3075/4885TNK2 3485/4885

“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.