SCHEMBL20172877

SCHEMBL20172877

Cc1cccc2c1sc1c(N(C)c3ccccc3F)cccc12

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.37
POLB P06746 2/20 0.33
MAPT P10636 2/20 0.33
LMNA P02545 1/20 0.33
ALDH1A1 P00352 3/20 0.32
NPSR1 Q6W5P4 1/20 0.32
CYP2A6 P11509 2/20 0.32
CYP1A2 P05177 1/20 0.31
TDP1 Q9NUW8 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
SCHEMBL20172889 0.89 ALDH1A1 (0.34) POLBMAPTALDH1A1NPSR1
SCHEMBL20172885 0.88 ACHE (0.37) ACHEPOLBMAPTLMNAALDH1A1
SCHEMBL20172875 0.87 CYP1A2 (0.35) ALDH1A1NPSR1CYP2A6CYP1A2
SCHEMBL20650364 0.84 ACHE (0.36) ACHEPOLBMAPTLMNAALDH1A1
SCHEMBL20172871 0.83 GPR3 (0.39) POLBMAPTALDH1A1NPSR1
SCHEMBL21021492 0.81 CHKA (0.36) ALDH1A1CYP2A6CYP1A2
SCHEMBL21020013 0.81 ALDH1A1 (0.37) POLBMAPTALDH1A1NPSR1CYP1A2
SCHEMBL20172939 0.81 ALDH1A1 (0.31) POLBALDH1A1NPSR1
SCHEMBL20172916 0.81 ACP1 (0.33) POLBALDH1A1NPSR1CYP1A2
SCHEMBL20172911 0.81 ALDH1A1 (0.33) POLBALDH1A1NPSR1

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 ACHE 337/4885POLB 3877/4885MAPT 754/4885
US-10651411-B2 Compound and organic light emitting device containing same CRY1, CRY2, OR10J3 ACHE 337/4885POLB 3877/4885MAPT 754/4885

“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.