SCHEMBL21498259

SCHEMBL21498259

Cc1ccc(-c2cccc3c2C(=O)c2ccccc2-3)c(Cl)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 2/20 0.55
▸ POLB P06746 1/20 0.51
▸ CYP1A1 P04798 1/20 0.47
▸ CYP1A2 P05177 1/20 0.47
▸ MAPT P10636 5/20 0.47
▸ ALDH1A1 P00352 3/20 0.47
▸ SMN1; SMN2 Q16637 3/20 0.47
▸ LMNA P02545 2/20 0.47
▸ MEN1 O00255 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ KDM4E B2RXH2 1/20 0.47
▸ S100A4 P26447 1/20 0.44
▸ MAOA P21397 1/20 0.43
▸ MAOB P27338 1/20 0.43
▸ ALKBH3 Q96Q83 1/20 0.42
▸ ADORA2A P29274 1/20 0.41
▸ RAB9A P51151 3/20 0.41
▸ NPC1 O15118 2/20 0.41
▸ PTPRC P08575 1/20 0.41
▸ MITF O75030 1/20 0.41

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
SCHEMBL19299398 0.80 PTPRC (0.55) POLBCYP1A1CYP1A2MAPTALDH1A1
SCHEMBL21498278 0.77 CYP1A1 (0.55) ELANEPOLBCYP1A1CYP1A2MAPT
SCHEMBL19299612 0.77 S100A4 (0.58) ELANEPOLBCYP1A1CYP1A2MAPT
SCHEMBL26187277 0.77 ELANE (0.65) ELANEPOLBCYP1A1CYP1A2MAPT
SCHEMBL30610015 0.77 ELANE (0.65) ELANEPOLBCYP1A1CYP1A2MAPT
SCHEMBL20618737 0.76 POLB (0.55) ELANEPOLBMAPTALDH1A1SMN1; SMN2
SCHEMBL23989075 0.76 MAPT (0.53) ELANEPOLBMAPTALDH1A1SMN1; SMN2
SCHEMBL19299604 0.76 DNMT1 (0.44) POLBCYP1A1CYP1A2MAPTALDH1A1
SCHEMBL19299394 0.75 PTPRC (0.44) ELANEPOLBCYP1A1CYP1A2MAPT
SCHEMBL11507014 0.75 NPC1 (0.46) ELANECYP1A2LMNAMAOAMAOB

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-11538996-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2022-12-27 — — US disclosed
EP-3419960-B1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2020-07-01 — — EP disclosed
US-10454041-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2019-10-22 — — 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-10454041-B2 Materials for organic electroluminescent devices RIF1, INTS9, LEF1 ELANE 300/4885POLB 1508/4885CYP1A1 20/4885
US-11538996-B2 Materials for organic electroluminescent devices RIF1, INTS9, LEF1 ELANE 300/4885POLB 1508/4885CYP1A1 20/4885

“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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