SCHEMBL20172871

SCHEMBL20172871

CN(c1ccccc1F)c1cccc2c1sc1ccccc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 1/20 0.39
PARP14 Q460N5 1/20 0.37
ALOX5 P09917 1/20 0.36
HRH1 P35367 4/20 0.36
MAPT P10636 2/20 0.36
CYP2D6 P10635 3/20 0.35
CHRM1 P11229 2/20 0.35
KCNH2 Q12809 2/20 0.35
ALDH1A1 P00352 3/20 0.33
POLB P06746 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
L3MBTL1 Q9Y468 4/20 0.33
RAB9A P51151 2/20 0.33
ATM Q13315 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
PIM1 P11309 1/20 0.32
PIM2 Q9P1W9 1/20 0.32
HTR2A P28223 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
SCHEMBL20733887 0.90 GPR3 (0.48) GPR3PARP14ALOX5MAPTALDH1A1
SCHEMBL20172889 0.87 ALDH1A1 (0.34) MAPTALDH1A1POLBNPSR1KDM4E
SCHEMBL20172877 0.83 ACHE (0.37) MAPTALDH1A1POLBNPSR1
SCHEMBL20172780 0.83 SIGMAR1 (0.45) GPR3PARP14ALOX5MAPTCYP2D6
SCHEMBL20172866 0.83 GPR3 (0.41) GPR3PARP14ALOX5HRH1MAPT
SCHEMBL20172911 0.82 ALDH1A1 (0.33) ALDH1A1POLBNPSR1
SCHEMBL21020583 0.82 HRH1 (0.39) GPR3PARP14ALOX5HRH1MAPT
SCHEMBL20650796 0.81 GPR3 (0.39) GPR3PARP14ALOX5HRH1MAPT
SCHEMBL2742930 0.81 GPR3 (0.42) GPR3PARP14ALOX5MAPTALDH1A1
SCHEMBL20172874 0.81 GPR3 (0.36) GPR3PARP14ALOX5MAPTCYP2D6

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-10651411-B2 Compound and organic light emitting device containing same LG CHEM, LTD. (KR) 2020-05-12 US disclosed
US-20180145272-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE CONTAINING SAME LG CHEM, LTD. (KR) 2018-05-24 US disclosed
US-20180145272-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE CONTAINING SAME LG CHEM, LTD. (KR) 2018-05-24 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-20180145272-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE CONTAINING SAME CRY1, CRY2, OR10J3 GPR3 2049/4885PARP14 3288/4885ALOX5 695/4885
US-10651411-B2 Compound and organic light emitting device containing same CRY1, CRY2, OR10J3 GPR3 2049/4885PARP14 3288/4885ALOX5 695/4885

“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.