SCHEMBL22100002

SCHEMBL22100002

c1ccc2c(c1)sc1c(-c3cccc4c5ccccc5n(-c5nccc6c5sc5ccccc56)c34)cccc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP14 Q460N5 1/20 0.39
ALOX5 P09917 1/20 0.39
PRKDC P78527 7/20 0.36
PIK3CD O00329 2/20 0.36
PIK3CB P42338 2/20 0.36
DUSP3 P51452 1/20 0.36
HTT P42858 1/20 0.35
PAX8 Q06710 1/20 0.35
BRD4 O60885 1/20 0.34
PIK3CA P42336 1/20 0.34
MTOR P42345 1/20 0.34
PIK3CG P48736 1/20 0.34
KCNH2 Q12809 1/20 0.34
BRDT Q58F21 1/20 0.34
CCNC P24863 1/20 0.34
CDK8 P49336 1/20 0.34
ADK P55263 1/20 0.32
GPR3 P46089 1/20 0.32
LIMK1 P53667 1/20 0.31
CDK5 Q00535 1/20 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
SCHEMBL22100154 0.90 ALOX5 (0.34) PARP14ALOX5PRKDCPIK3CDPIK3CB
SCHEMBL22074640 0.88 ALOX5 (0.33) ALOX5DUSP3PIK3CAGPR3LIMK1
SCHEMBL22100039 0.87 ALOX5 (0.33) PARP14ALOX5PRKDCPIK3CDPIK3CB
SCHEMBL21316763 0.87 GPR3 (0.39) PARP14ALOX5PIK3CAGPR3LIMK1
SCHEMBL22074656 0.86 TP53 (0.33) ALOX5PRKDCDUSP3CCNCCDK8
SCHEMBL22100025 0.85 ALOX5 (0.34) PARP14ALOX5PRKDCPIK3CDPIK3CB
SCHEMBL22100157 0.85 PRKDC (0.34) PARP14ALOX5PRKDCPIK3CDPIK3CB
SCHEMBL22100029 0.85 ALOX5 (0.36) PARP14ALOX5PRKDCPIK3CDPIK3CB
SCHEMBL22100000 0.85 ALOX5 (0.33) ALOX5DUSP3PIK3CAGPR3LIMK1
SCHEMBL18593800 0.84 ATM (0.41) GPR3LIMK1CDK5CDK5R1

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-11834459-B2 Host materials for electroluminescent devices UNIVERSAL DISPLAY CORPORATION (US) 2023-12-05 US disclosed
US-11834459-B2 Host materials for electroluminescent devices UNIVERSAL DISPLAY CORPORATION (US) 2023-12-05 US disclosed
US-20200190103-A1 HOST MATERIALS FOR ELECTROLUMINESCENT DEVICES UNIVERSAL DISPLAY CORPORATION 2020-06-18 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-20200190103-A1 HOST MATERIALS FOR ELECTROLUMINESCENT DEVICES RPS4X, MLX, RPS4Y1 PARP14 2524/4885ALOX5 3051/4885PRKDC 3292/4885
US-11834459-B2 Host materials for electroluminescent devices RPS4X, MLX, RPS4Y1 PARP14 2524/4885ALOX5 3051/4885PRKDC 3292/4885

“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.