SCHEMBL16558677

SCHEMBL16558677

FC(F)(F)c1cc(-c2ccc3c4ccccc4c4ccccc4c3c2)cc(-c2cccc3c2sc2ccccc23)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.50
PRKDC P78527 4/20 0.39
PARP14 Q460N5 1/20 0.36
SLC9A1 P19634 2/20 0.35
MAOB P27338 2/20 0.32
PIK3CD O00329 1/20 0.32
BRD4 O60885 1/20 0.32
PIK3CA P42336 1/20 0.32
PIK3CB P42338 1/20 0.32
MTOR P42345 1/20 0.32
PIK3CG P48736 1/20 0.32
KCNH2 Q12809 1/20 0.32
BRDT Q58F21 1/20 0.32
TP53 P04637 1/20 0.32
GPR3 P46089 1/20 0.32
PMM2 O15305 1/20 0.32
MPI P34949 1/20 0.32
PHOSPHO1 Q8TCT1 1/20 0.32
ALDH1A1 P00352 2/20 0.31
RAB9A P51151 2/20 0.31

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
SCHEMBL12175611 0.89 ALOX5 (0.60) ALOX5PRKDCPARP14PIK3CDBRD4
SCHEMBL14924595 0.89 ALOX5 (0.60) ALOX5PRKDCPARP14PIK3CDBRD4
SCHEMBL16561793 0.89 ALOX5 (0.36) ALOX5MAOBALDH1A1MAOAKDM4E
SCHEMBL25118636 0.88 ALOX5 (0.58) ALOX5PRKDCPARP14PIK3CDBRD4
SCHEMBL25118644 0.88 ALOX5 (0.58) ALOX5PRKDCPARP14PIK3CDBRD4
SCHEMBL18960985 0.88 ALOX5 (0.50) ALOX5PRKDCPARP14PIK3CDBRD4
SCHEMBL16303791 0.85 ALOX5 (0.56) ALOX5PRKDCPARP14SLC9A1PIK3CD
SCHEMBL30393630 0.85 ALOX5 (0.56) ALOX5PRKDCPARP14SLC9A1PIK3CD
SCHEMBL24257894 0.85 ALOX5 (0.56) ALOX5PRKDCPARP14SLC9A1PIK3CD
SCHEMBL18961003 0.85 ALOX5 (0.56) ALOX5PRKDCPARP14SLC9A1PIK3CD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10804469-B2 Charge transport material, organic electroluminescent element, and illumination device, display device, or light-emitting device characterized by using said element UDC IRELAND LIMITED (IE) 2020-10-13 US disclosed
US-20150069332-A1 CHARGE TRANSPORT MATERIAL, OGANIC ELECTROLUMINESCENT ELEMENT, AND ILLUMINATION DEVICE, DISPLAY DEVICE, OR LIGHT-EMITTING DEVICE CHARACTERIZED BY USING SAID ELEMENT UDC IRELAND LIMITED (IE) 2015-03-12 US disclosed
US-20150069332-A1 CHARGE TRANSPORT MATERIAL, OGANIC ELECTROLUMINESCENT ELEMENT, AND ILLUMINATION DEVICE, DISPLAY DEVICE, OR LIGHT-EMITTING DEVICE CHARACTERIZED BY USING SAID ELEMENT UDC IRELAND LIMITED (IE) 2015-03-12 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-10804469-B2 Charge transport material, organic electroluminescent element, and illumination device, display device, or light-emitting device characterized by using said element ITGAL, ITGA1, ITGB1 ALOX5 4247/4885PRKDC 4222/4885PARP14 4439/4885

“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.