SCHEMBL12759471

SCHEMBL12759471

CC(C)(C)c1cn(-c2ccccn2)cn1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.43
EGLN2 Q96KS0 1/20 0.40
CPB2 Q96IY4 8/20 0.39
CPB1 P15086 1/20 0.39
POLB P06746 1/20 0.38
GRM5 P41594 1/20 0.38
ALDH1A1 P00352 1/20 0.36
HTT P42858 1/20 0.36
HSD17B10 Q99714 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
MAPT P10636 1/20 0.35
PLD1 Q13393 1/20 0.35
TUBB4A P04350 1/20 0.35
TUBB P07437 1/20 0.35
TUBA3C P0DPH7 1/20 0.35
TUBA1B P68363 1/20 0.35
TUBA4A P68366 1/20 0.35
TUBB4B P68371 1/20 0.35
TUBB3 Q13509 1/20 0.35
TUBB2A Q13885 1/20 0.35

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
SCHEMBL22199029 0.77 EGLN2 (0.60) SMN1; SMN2EGLN2CPB2CPB1POLB
SCHEMBL11954983 0.77 NPC1 (0.41) CPB2CPB1POLBALDH1A1MAPT
SCHEMBL11899175 0.73 GCG (0.36) EGLN2CPB2POLBGRIN2B
SCHEMBL2159955 0.73 NOS3 (0.45) SMN1; SMN2EGLN2CPB2CPB1POLB
SCHEMBL30337851 0.73 SMN1; SMN2 (0.43) SMN1; SMN2EGLN2CPB2CPB1POLB
SCHEMBL6172976 0.73 SMN1; SMN2 (0.43) SMN1; SMN2EGLN2CPB2CPB1POLB
SCHEMBL31095576 0.73 NOS3 (0.45) SMN1; SMN2EGLN2CPB2CPB1POLB
SCHEMBL22185839 0.72 CPB2 (0.44) SMN1; SMN2EGLN2CPB2CPB1POLB
SCHEMBL14646922 0.72 CPB2 (0.48) SMN1; SMN2CPB2CPB1TUBB4ATUBB
SCHEMBL10183027 0.71 CYP2E1 (0.38) SMN1; SMN2CPB2CPB1

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-11820766-B2 Monoacylglycerol lipase modulators JANSSEN PHARMACEUTICA NV (BE) 2023-11-21 US disclosed
US-20150311455-A1 Method Of Forming Metal Complex Compound, And Organic Electroluminescence Device UDC IRELAND LTD (IE) 2015-10-29 US disclosed
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-9062084-B2 Method of forming metal complex compound, and organic electroluminescence device UDC Ireland (IE) 2015-06-23 US disclosed
US-20110050093-A1 METHOD OF FORMING METAL COMPLEX COMPOUND, AND ORGANIC ELECTROLUMINESCENCE DEVICE FUJIFILM CORPORATION (JP) 2011-03-03 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 (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-20110050093-A1 METHOD OF FORMING METAL COMPLEX COMPOUND, AND ORGANIC ELECTROLUMINESCENCE DEVICE ZFR, PORCN, OR10J3 SMN1; SMN2 3510/4885EGLN2 4623/4885CPB2 3302/4885
US-20150311455-A1 Method Of Forming Metal Complex Compound, And Organic Electroluminescence Device ZFR, PORCN, OR10J3 SMN1; SMN2 3510/4885EGLN2 4623/4885CPB2 3302/4885
US-11820766-B2 Monoacylglycerol lipase modulators MGLL, LPL, PNLIP SMN1; SMN2 3418/4885EGLN2 4418/4885CPB2 2621/4885

“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.