SCHEMBL17034602

SCHEMBL17034602

O=C1c2ccccc2-c2cccc(Nc3cc(-c4ccccc4)ccc3Cl)c21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.46
▸ SMN1; SMN2 Q16637 3/20 0.46
▸ LMNA P02545 3/20 0.46
▸ RAB9A P51151 2/20 0.46
▸ L3MBTL1 Q9Y468 2/20 0.46
▸ MEN1 O00255 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ APAF1 O14727 1/20 0.46
▸ NPC1 O15118 1/20 0.46
▸ THRB P10828 1/20 0.46
▸ XBP1 P17861 1/20 0.46
▸ PTBP1 P26599 1/20 0.46
▸ HTT P42858 1/20 0.46
▸ GALK1 P51570 1/20 0.46
▸ BLM P54132 1/20 0.46
▸ SMAD3 P84022 1/20 0.46
▸ ATM Q13315 1/20 0.46
▸ NPSR1 Q6W5P4 1/20 0.46
▸ CYP1A2 P05177 2/20 0.45
▸ MAPK1 P28482 2/20 0.45

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
SCHEMBL17034555 0.89 CYP1A2 (0.48) MAPTSMN1; SMN2LMNARAB9AL3MBTL1
SCHEMBL17029053 0.82 DHODH (0.54) MAPTSMN1; SMN2LMNARAB9AL3MBTL1
SCHEMBL17034605 0.78 CYP1A2 (0.44) MAPTSMN1; SMN2LMNARAB9AL3MBTL1
SCHEMBL11791498 0.77 CXCL8 (0.48) MAPTSMN1; SMN2RAB9AL3MBTL1MEN1
SCHEMBL11605803 0.76 MAPK1 (0.53) MAPTSMN1; SMN2LMNARAB9AL3MBTL1
SCHEMBL24796288 0.74 LMNA (0.46) MAPTSMN1; SMN2LMNARAB9AL3MBTL1
SCHEMBL11659244 0.74 MAPT (0.56) MAPTSMN1; SMN2LMNARAB9AL3MBTL1
SCHEMBL11797485 0.74 PTPN1 (0.49) CYP1A2FABP3FABP4P2RY4EGFR
SCHEMBL11058968 0.73 MAPK1 (0.59) MAPTSMN1; SMN2LMNARAB9AL3MBTL1
SCHEMBL11790953 0.73 CYP1A2 (0.47) MAPTSMN1; SMN2LMNARAB9AL3MBTL1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11245079-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2022-02-08 — — US disclosed
US-20190280217-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2019-09-12 — — US disclosed
EP-3107977-B1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2018-01-24 — — EP disclosed
US-20170062732-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2017-03-02 — — US disclosed
US-20170062732-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2017-03-02 — — US disclosed
WO-2015124255-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2015-08-27 — — WO 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 (3 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-20170062732-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES OR10J3, L1CAM, EPCAM MAPT 711/4885SMN1; SMN2 3778/4885LMNA 3052/4885
US-11245079-B2 Materials for organic electroluminescent devices OR10J3, L1CAM, EPCAM MAPT 711/4885SMN1; SMN2 3778/4885LMNA 3052/4885
US-20190280217-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES OR10J3, L1CAM, EPCAM MAPT 711/4885SMN1; SMN2 3778/4885LMNA 3052/4885

“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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