SCHEMBL10074362

SCHEMBL10074362

N#C/N=C1\c2ccccc2-c2nc3cc(C(F)(F)F)c(C(F)(F)F)cc3nc21

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
USP8 P40818 5/20 0.36
PIK3R1 P27986 2/20 0.36
PIK3CA P42336 2/20 0.36
AR P10275 5/20 0.35
MAPK8 P45983 2/20 0.35
MAPK9 P45984 2/20 0.35
MAPK10 P53779 2/20 0.35
MAPT P10636 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
TRPA1 O75762 1/20 0.34
CTSK P43235 1/20 0.34
PGR P06401 1/20 0.33
ACP1 P24666 1/20 0.32

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
SCHEMBL10074361 0.85 KDM4E (0.48) USP8MAPK8MAPK9MAPK10MAPT
SCHEMBL10075006 0.84 PIK3R1 (0.42) PIK3R1PIK3CAARMAPK8MAPK9
SCHEMBL10075002 0.83 PIK3R1 (0.42) USP8PIK3R1PIK3CAMAPK8MAPK9
SCHEMBL10074696 0.81 PIK3R1 (0.39) PIK3R1PIK3CAMAPTRAB9ASMN1; SMN2
SCHEMBL10074697 0.81 PIK3R1 (0.39) PIK3R1PIK3CAMAPTRAB9ASMN1; SMN2
SCHEMBL10074707 0.81 TP53 (0.37) USP8PIK3R1PIK3CAARMAPK8
SCHEMBL10075464 0.79 AR (0.55) ARPGR
SCHEMBL10075003 0.79 ALDH1A1 (0.39) USP8MAPK8MAPK9MAPK10MAPT
SCHEMBL10075448 0.78 MEN1 (0.36) USP8MAPTSMN1; SMN2CTSK
SCHEMBL10050430 0.78 PIK3R1 (0.36) USP8PIK3R1PIK3CAMAPK8MAPK9

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
US-8119828-B2 Material for an organic electroluminescence device and an organic electroluminescence device IDEMITSU KOSAN CO., LTD. (JP) 2012-02-21 US disclosed
US-20100044686-A1 MATERIAL FOR AN ORGANIC ELECTROLUMINESCENCE DEVICE AND AN ORGANIC ELECTROLUMINESCENCE DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2010-02-25 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-20100044686-A1 MATERIAL FOR AN ORGANIC ELECTROLUMINESCENCE DEVICE AND AN ORGANIC ELECTROLUMINESCENCE DEVICE AFF4, KCNH3, HCN4 USP8 4307/4885PIK3R1 4703/4885PIK3CA 4322/4885

“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.