SCHEMBL11950306

SCHEMBL11950306

Cc1ccc(N(c2ccc(-c3ccc(N(c4ccc(C)cc4)c4ccc5c(c4)CC5)cc3)cc2)c2ccc3c(c2)CC3)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.36
▸ NPC1 O15118 2/20 0.36
▸ RAB9A P51151 2/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ MAPT P10636 1/20 0.36
▸ NFKB1 P19838 1/20 0.36
▸ NFKB2 Q00653 1/20 0.36
▸ RELA Q04206 1/20 0.36
▸ TSHR P16473 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ ADCY8 P40145 1/20 0.34
▸ ADCY1 Q08828 1/20 0.34
▸ MCHR1 Q99705 1/20 0.34
▸ LMNA P02545 2/20 0.33
▸ DPP4 P27487 1/20 0.33
▸ THRB P10828 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ MCL1 Q07820 1/20 0.33
▸ ESR1 P03372 1/20 0.31
▸ ESR2 Q92731 1/20 0.31

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
SCHEMBL13174481 0.94 ALDH1A1 (0.39) ALDH1A1NPC1RAB9ASMN1; SMN2MAPT
SCHEMBL2607300 0.94 ALDH1A1 (0.39) ALDH1A1NPC1RAB9ASMN1; SMN2MAPT
SCHEMBL24159881 0.94 ALDH1A1 (0.39) ALDH1A1NPC1RAB9ASMN1; SMN2MAPT
SCHEMBL12606451 0.93 KCNA1 (0.37) ALDH1A1NPC1RAB9ASMN1; SMN2MAPT
SCHEMBL2951416 0.93 NPC1 (0.43) ALDH1A1NPC1RAB9ASMN1; SMN2MAPT
SCHEMBL13152227 0.93 DPP4 (0.41) ALDH1A1NPC1RAB9ASMN1; SMN2MAPT
SCHEMBL12619835 0.93 ADCY8 (0.36) ALDH1A1NPC1RAB9ASMN1; SMN2MAPT
SCHEMBL12619670 0.93 ADCY8 (0.36) ALDH1A1NPC1RAB9ASMN1; SMN2MAPT
SCHEMBL15165447 0.88 ESR1 (0.36) ALDH1A1NPC1RAB9ASMN1; SMN2MAPT
SCHEMBL17430706 0.87 ALDH1A1 (0.39) ALDH1A1NPC1RAB9ASMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140299864-A1 POLYMERS CONTAINING THERMALLY DISSOCIABLE AND SOLUBLE GROUPS AND THE USE OF SUCH POLYMERS AS ORGANIC ELECTROLUMINESCENT MATERIALS MITSUBISHI CHEMICAL CORPORATION (JP) 2014-10-09 — — US disclosed
US-20140299864-A1 POLYMERS CONTAINING THERMALLY DISSOCIABLE AND SOLUBLE GROUPS AND THE USE OF SUCH POLYMERS AS ORGANIC ELECTROLUMINESCENT MATERIALS MITSUBISHI CHEMICAL CORPORATION (JP) 2014-10-09 — — US disclosed
US-8795849-B2 Polymers containing thermally dissociable and soluble groups and the use of such polymers as organic electroluminescent materials MITSUBISHI CHEMICAL CORPORATION (JP) 2014-08-05 — — US disclosed
US-8795849-B2 Polymers containing thermally dissociable and soluble groups and the use of such polymers as organic electroluminescent materials MITSUBISHI CHEMICAL CORPORATION (JP) 2014-08-05 — — US disclosed
US-20120193617-A1 LOW-MOLECULAR COMPOUND, POLYMER, ELECTRONIC-DEVICE MATERIAL, COMPOSITION FOR ELECTRONIC DEVICE, ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC SOLAR CELL ELEMENT, DISPLAY AND LIGHTING MITSUBISHI CHEMICAL CORPORATION (JP) 2012-08-02 — — US disclosed
US-20120193617-A1 LOW-MOLECULAR COMPOUND, POLYMER, ELECTRONIC-DEVICE MATERIAL, COMPOSITION FOR ELECTRONIC DEVICE, ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC SOLAR CELL ELEMENT, DISPLAY AND LIGHTING MITSUBISHI CHEMICAL CORPORATION (JP) 2012-08-02 — — US disclosed
US-20110192464-A1 POLYMER, LUMINESCENT-LAYER MATERIAL, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE ELEMENT, COMPOSITION FOR ORGANIC ELECTROLUMINESCENCE ELEMENT, AND ORGANIC ELECTROLUMINESCENCE ELEMENT, SOLAR CELL ELEMENT, ORGANIC EL DISPLAY, AND ORGANIC EL LIGHTING EACH OBTAINED USING THESE MITSUBISHI CHEMICAL CORPORATION (JP) 2011-08-11 — — 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-20120193617-A1 LOW-MOLECULAR COMPOUND, POLYMER, ELECTRONIC-DEVICE MATERIAL, COMPOSITION FOR ELECTRONIC DEVICE, ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC SOLAR CELL ELEMENT, DISPLAY AND LIGHTING EPCAM, CDH1, THEM6 ALDH1A1 2277/4885NPC1 2619/4885RAB9A 2300/4885
US-20110192464-A1 POLYMER, LUMINESCENT-LAYER MATERIAL, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE ELEMENT, COMPOSITION FOR ORGANIC ELECTROLUMINESCENCE ELEMENT, AND ORGANIC ELECTROLUMINESCENCE ELEMENT, SOLAR CELL ELEMENT, ORGANIC EL DISPLAY, AND ORGANIC EL LIGHTING EACH OBTAINED USING THESE LEF1, EPCAM, EBPL ALDH1A1 2184/4885NPC1 2352/4885RAB9A 896/4885

“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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