SCHEMBL21928506

SCHEMBL21928506

N#Cc1ccc(-c2c(F)cncc2F)cc1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CYP11B2 P19099 9/20 0.47
▸ CYP11B1 P15538 7/20 0.47
▸ KIF11 P52732 2/20 0.43
▸ MMP3 P08254 1/20 0.42
▸ EGLN2 Q96KS0 2/20 0.41
▸ BRAF P15056 1/20 0.40
▸ KDR P35968 1/20 0.40
▸ GCGR P47871 2/20 0.40
▸ MAPK14 Q16539 2/20 0.40
▸ MAPK13 O15264 1/20 0.40
▸ ALOX5 P09917 1/20 0.40
▸ MAPK12 P53778 1/20 0.40
▸ MAPK11 Q15759 1/20 0.40
▸ NPY5R Q15761 1/20 0.40
▸ RIPK1 Q13546 1/20 0.39

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
SCHEMBL14555704 0.79 AR (0.47) CYP11B2KIF11MMP3EGLN2
SCHEMBL19917498 0.79 KIF11 (0.50) CYP11B2CYP11B1KIF11MMP3EGLN2
SCHEMBL19579181 0.79 KIF11 (0.48) CYP11B2KIF11MMP3EGLN2
SCHEMBL21929166 0.78 IDO1 (0.55) CYP11B2CYP11B1NPY5R
SCHEMBL19579104 0.78 KIF11 (0.58) CYP11B2CYP11B1KIF11MMP3EGLN2
SCHEMBL9987705 0.76 CYP11B2 (0.51) CYP11B2CYP11B1GCGRMAPK14
SCHEMBL3509636 0.75 MMP3 (0.59) CYP11B2KIF11MMP3
SCHEMBL16604324 0.74 ALDH1A1 (0.50) CYP11B2CYP11B1KIF11MMP3EGLN2
SCHEMBL4147130 0.74 KIF11 (0.48) CYP11B2KIF11MMP3EGLN2BRAF
SCHEMBL16922704 0.73 KIF11 (0.45) CYP11B2CYP11B1KIF11MMP3

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-20220388960-A1 ORGANIC MOLECULES FOR USE IN LIGHT-EMITTING DEVICES CYNORA GMBH (DE) 2022-12-08 — — US disclosed
EP-3609978-B1 ORGANIC MOLECULES IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2021-03-17 — — EP disclosed
US-20200136054-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2020-04-30 — — 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-20200136054-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES OR10J3, OGFR, OR51E2 CYP11B2 902/4885CYP11B1 1431/4885KIF11 4417/4885
US-20220388960-A1 ORGANIC MOLECULES FOR USE IN LIGHT-EMITTING DEVICES ALDH1A2, AOX1, CYBA CYP11B2 163/4885CYP11B1 432/4885KIF11 3588/4885

“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.

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