SCHEMBL11987006

SCHEMBL11987006

Cc1ccn(-c2cccc(C(C)(C)c3cccc(-n4ccc(C(F)(F)F)n4)n3)n2)n1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.58
NPC1 O15118 4/20 0.58
RAB9A P51151 4/20 0.58
SMN1; SMN2 Q16637 2/20 0.58
ATM Q13315 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
PRMT6 Q96LA8 1/20 0.42
PDE10A Q9Y233 1/20 0.37
IDH1 O75874 4/20 0.36
IDH2 P48735 1/20 0.36
PHGDH O43175 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
GRIN2B Q13224 1/20 0.33
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 2/20 0.33
GAA P10253 1/20 0.33
CYP17A1 P05093 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
CBLB Q13191 1/20 0.32

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
SCHEMBL11987645 0.93 NPC1 (0.45) MAPTNPC1RAB9ASMN1; SMN2ATM
SCHEMBL10327009 0.85 MAPT (0.39) MAPTNPC1RAB9ASMN1; SMN2ATM
SCHEMBL13780070 0.81 NPC1 (0.47) MAPTNPC1RAB9ASMN1; SMN2ATM
SCHEMBL10326651 0.78 NPC1 (0.37) MAPTNPC1RAB9ASMN1; SMN2ATM
SCHEMBL17660049 0.78 MAPT (0.38) MAPTNPC1RAB9ASMN1; SMN2ATM
SCHEMBL10326643 0.77 NPC1 (0.36) MAPTNPC1RAB9ASMN1; SMN2ATM
SCHEMBL11987008 0.76 MAPT (0.48) MAPTNPC1RAB9ASMN1; SMN2ATM
SCHEMBL197523 0.75 MAPT (1.00) MAPTNPC1RAB9ASMN1; SMN2ATM
SCHEMBL14198216 0.75 IDH1 (0.40) MAPTNPC1RAB9ASMN1; SMN2ATM
SCHEMBL10326677 0.74 IDH1 (0.35) MAPTNPC1RAB9ASMN1; SMN2ATM

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-20150311455-A1 Method Of Forming Metal Complex Compound, And Organic Electroluminescence Device UDC IRELAND LTD (IE) 2015-10-29 US disclosed
US-9062084-B2 Method of forming metal complex compound, and organic electroluminescence device UDC Ireland (IE) 2015-06-23 US disclosed
US-20120309970-A1 PLATINUM COMPLEX COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE UDC IRELAND LTD. (IE) 2012-12-06 US disclosed
US-8247091-B2 Platinum complex compound and organic electroluminescent device FUJIFILM CORPORATION (JP) 2012-08-21 US disclosed
US-20110234090-A1 PLATINUM COMPLEX COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE FUJIFILM CORPORATION (JP) 2011-09-29 US disclosed
US-20110050093-A1 METHOD OF FORMING METAL COMPLEX COMPOUND, AND ORGANIC ELECTROLUMINESCENCE DEVICE FUJIFILM CORPORATION (JP) 2011-03-03 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 (4 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-20110050093-A1 METHOD OF FORMING METAL COMPLEX COMPOUND, AND ORGANIC ELECTROLUMINESCENCE DEVICE ZFR, PORCN, OR10J3 MAPT 1946/4885NPC1 2788/4885RAB9A 2280/4885
US-20150311455-A1 Method Of Forming Metal Complex Compound, And Organic Electroluminescence Device ZFR, PORCN, OR10J3 MAPT 1946/4885NPC1 2788/4885RAB9A 2280/4885
US-20120309970-A1 PLATINUM COMPLEX COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE L1CAM, LIG1, ZC3HAV1L MAPT 1900/4885NPC1 3900/4885RAB9A 1622/4885
US-20110234090-A1 PLATINUM COMPLEX COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE L1CAM, LIG1, ZC3HAV1L MAPT 1900/4885NPC1 3900/4885RAB9A 1622/4885

“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.