SCHEMBL10066877

SCHEMBL10066877

c1cc(-n2ccnc2)nc(-n2ccnc2)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 10/20 0.54
CYP1A2 P05177 8/20 0.51
CYP2D6 P10635 8/20 0.51
TDP1 Q9NUW8 6/20 0.51
LMNA P02545 5/20 0.51
MAPK1 P28482 4/20 0.51
ALDH1A1 P00352 4/20 0.51
HSD17B10 Q99714 4/20 0.51
CYP2C19 P33261 7/20 0.50
ALOX15 P16050 5/20 0.50
HPGD P15428 1/20 0.50
HIF1A Q16665 1/20 0.50
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
IDO1 P14902 2/20 0.48
USP2 O75604 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
GAA P10253 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP19A1 P11511 1/20 0.48

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
SCHEMBL28614447 0.98 CYP3A4 (0.52) CYP3A4CYP1A2CYP2D6TDP1LMNA
SCHEMBL16923125 0.90 CYP3A4 (0.48) CYP3A4CYP1A2CYP2D6TDP1LMNA
SCHEMBL29464261 0.86 CYP19A1 (0.46) CYP3A4CYP1A2CYP2D6TDP1LMNA
SCHEMBL2658834 0.86 CYP19A1 (0.46) CYP3A4CYP1A2CYP2D6TDP1LMNA
SCHEMBL12487845 0.86 LMNA (0.47) CYP3A4CYP1A2CYP2D6TDP1LMNA
SCHEMBL2643486 0.86 CYP3A4 (0.51) CYP3A4CYP1A2CYP2D6TDP1LMNA
SCHEMBL13805938 0.86 CYP3A4 (0.51) CYP3A4CYP1A2CYP2D6TDP1LMNA
SCHEMBL31138265 0.86 CYP3A4 (0.46) CYP3A4CYP1A2CYP2D6TDP1LMNA
SCHEMBL12877192 0.86 ALDH1A1 (0.53) CYP3A4CYP1A2CYP2D6TDP1LMNA
SCHEMBL13705859 0.82 PDE10A (0.56) CYP3A4CYP1A2CYP2D6TDP1LMNA

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 55 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119931086-A MOF material for negative carbon hydrogen production and preparation and application methods thereof 常州大学 2025-05-06 CN claimed
CN-119857380-A Gas separation membrane based on metal organic cage and preparation method and application thereof 天津大学 2025-04-22 CN claimed
CN-115466275-A Fluorescent visual identification probe and method for latent fingerprints on substrate 复旦大学 2022-12-13 CN claimed
CN-113416204-A Coordination polymer crystal material containing 2, 6-diimidazole pyridine and preparation method thereof 江苏大学 2021-09-21 CN claimed
CN-113336778-A Fluorescent visual identification probe and method for latent fingerprints on substrate 复旦大学 2021-09-03 CN claimed
US-20200171474-A1 CATALYSTS FOR THE TRANSFORMATION OF CARBON DIOXIDE AND GLYCEROL TO FORMIC ACID AND LACTIC ACID AND METHODS OF MAKING THE SAME THE GEORGE WASHINGTON UNIVERSITY 2020-06-04 US claimed
WO-2018213821-A1 CATALYSTS FOR THE TRANSFORMATION OF CARBON DIOXIDE AND GLYCEROL TO FORMIC ACID AND LACTIC ACID AND METHODS OF MAKING THE SAME THE GEORGE WASHINGTON UNIVERSITY (US) 2018-11-22 WO claimed
CN-101440138-B Nickel olefin polymerizing catalyst, and preparation and use thereof UNIV FUDAN 2011-08-31 CN claimed
CN-101440138-A Nickel olefin polymerizing catalyst, and preparation and use thereof UNIV FUDAN (CN) 2009-05-27 CN claimed
CN-119931086-B MOF material for negative carbon hydrogen production and preparation and application methods thereof 常州大学 2025-12-23 CN disclosed
CN-119931086-A MOF material for negative carbon hydrogen production and preparation and application methods thereof 常州大学 2025-05-06 CN disclosed
CN-119931086-A MOF material for negative carbon hydrogen production and preparation and application methods thereof 常州大学 2025-05-06 CN disclosed
CN-119857380-A Gas separation membrane based on metal organic cage and preparation method and application thereof 天津大学 2025-04-22 CN disclosed
US-12194448-B2 Catalysts for the transformation of carbon dioxide and glycerol to formic acid and lactic acid and methods of making the same THE GEORGE WASHINGTON UNIVERSITY (US) 2025-01-14 US disclosed
US-8163851-B2 Polymeric salts and poly-NHC-metal complexes INSTITUTE OF BIOENGINEERING AND NANOTECHNOLOGY (SG) 2012-04-24 US disclosed
CN-101440138-B Nickel olefin polymerizing catalyst, and preparation and use thereof UNIV FUDAN 2011-08-31 CN disclosed
WO-2009111299-A2 TRIDENTATE PLATINUM (II) COMPLEXES ARIZONA BOARD OF REGENTS FOR AND ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2009-09-11 WO disclosed
US-20090227740-A1 Polymeric Salts and Poly-NHC-Metal Complexes INSTITUTE OF BIOENGINEERING AND NANOTECHNOLOGY (SG) 2009-09-10 US disclosed
CN-101440138-A Nickel olefin polymerizing catalyst, and preparation and use thereof UNIV FUDAN (CN) 2009-05-27 CN disclosed
CN-101432073-A Polyimidazolium salts and poly-N-heterocyclic carbene metal complexes AGENCY SCIENCE TECH & RES (SG) 2009-05-13 CN 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-12194448-B2 Catalysts for the transformation of carbon dioxide and glycerol to formic acid and lactic acid and methods of making the same MLX, LDHA, CA2 CYP3A4 3701/4885CYP1A2 3498/4885CYP2D6 3925/4885
US-20200171474-A1 CATALYSTS FOR THE TRANSFORMATION OF CARBON DIOXIDE AND GLYCEROL TO FORMIC ACID AND LACTIC ACID AND METHODS OF MAKING THE SAME MLX, LDHA, CA2 CYP3A4 3701/4885CYP1A2 3498/4885CYP2D6 3925/4885

“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.