SCHEMBL29985188

SCHEMBL29985188

Cc1ccc2ncncc2c1

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EGFR P00533 9/20 0.60
ALDH1A1 P00352 1/20 0.52
PIK3CD O00329 1/20 0.50
PIK3CA P42336 1/20 0.50
FGFR4 P22455 1/20 0.46
CYP1A2 P05177 3/20 0.45
IMPDH2 P12268 1/20 0.43
NCK1 P16333 1/20 0.42
BACE1 P56817 1/20 0.42
CYP2A6 P11509 1/20 0.42
NQO2 P16083 1/20 0.42
TDO2 P48775 1/20 0.42
AR P10275 1/20 0.41

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
SCHEMBL1771905 1.00 EGFR (0.60) EGFRALDH1A1PIK3CDPIK3CAFGFR4
SCHEMBL28801910 0.98 EGFR (0.58) EGFRALDH1A1PIK3CDPIK3CAFGFR4
SCHEMBL15147835 0.86 EGFR (0.55) EGFRALDH1A1PIK3CDPIK3CAFGFR4
SCHEMBL3535171 0.85 PIK3CA (0.61) EGFRPIK3CDPIK3CAFGFR4TDO2
SCHEMBL1771615 0.83 EGFR (0.60) EGFRALDH1A1CYP1A2IMPDH2CYP2A6
SCHEMBL27941975 0.82 EGFR (0.80) EGFRALDH1A1PIK3CDPIK3CAFGFR4
SCHEMBL21499259 0.80 EGFR (0.44) EGFRALDH1A1PIK3CDPIK3CAFGFR4
SCHEMBL29804792 0.79 PIK3CA (0.51) EGFRPIK3CDPIK3CAFGFR4CYP2A6
SCHEMBL8644295 0.78 PIK3CA (0.73) EGFRPIK3CDPIK3CAFGFR4TDO2
SCHEMBL29804751 0.78 PIK3CA (0.54) EGFRPIK3CDPIK3CAFGFR4CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2026101924-A1 KRAS MODULATORS ALTEROME THERAPEUTICS, INC. (US) 2026-05-15 WO disclosed
US-20260102395-A1 INHIBITING HISTONE DEACETYLASE 6 EIKONIZO THERAPEUTICS, INC. (US) 2026-04-16 US disclosed
CN-119504613-B Coumarin derivative containing quinazoline unit as well as preparation method and application thereof 江苏海洋大学 2026-02-27 CN disclosed
US-20250230166-A1 OXADIAZOLE HDAC6 INHIBITORS AND USES THEREOF EIKONIZO THERAPEUTICS, INC. (US) 2025-07-17 US disclosed
US-12286429-B2 5-oxo-1,2,3,5,8,8a-hexahydroindolizine-3-carboxamide derivatives useful as a factor XIa inhibitors JANSSEN PHARMACEUTICA NV (BE) 2025-04-29 US disclosed
CN-119504613-A Novel coumarin derivative containing quinazoline unit, and preparation method and application thereof 江苏海洋大学 2025-02-25 CN disclosed
US-20240327410-A1 Monoacylglycerol Lipase Modulators JANSSEN PHARMACEUTICA NV (BE) 2024-10-03 US disclosed
US-11993601-B2 Monoacylglycerol lipase modulators JANSSEN PHARMACEUTICA NV 2024-05-28 US disclosed
US-20230242531-A1 Monoacylglycerol Lipase Modulators JANSSEN PHARMACEUTICA NV (BE) 2023-08-03 US disclosed
US-11597728-B2 Monoacylglycerol lipase modulators JANSSEN PHARMACEUTICA NV (BE) 2023-03-07 US disclosed
US-20230064443-A1 5-oxo-1,2,3,5,8,8a-hexahydroindolizine-3-carboxamide Derivatives Useful As a Factor XIa Inhibitors JANSSEN PHARMACEUTICA NV (BE) 2023-03-02 US disclosed
WO-2022241484-A2 QUINAZOLINE DERIVATIVES TARGETING R(CCUG) REPEATS IN MYOTONIC DYSTROPHY TYPE 2 UNIVERSITY OF FLORIDA RESEARCHFOUNDATION, INCORPORATED (US) 2022-11-17 WO disclosed
US-20220315583-A1 Monoacylglycerol Lipase Modulators JANSSEN PHARMACEUTICA NV (BE) 2022-10-06 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 (9 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-20230242531-A1 Monoacylglycerol Lipase Modulators MGLL, LPL, PNLIP EGFR 1500/4885ALDH1A1 344/4885PIK3CD 855/4885
US-12286429-B2 5-oxo-1,2,3,5,8,8a-hexahydroindolizine-3-carboxamide derivatives useful as a factor XIa inhibitors F11, F12, F13A1 EGFR 2991/4885ALDH1A1 2307/4885PIK3CD 1779/4885
US-20250230166-A1 OXADIAZOLE HDAC6 INHIBITORS AND USES THEREOF HDAC6, HDAC1, HDAC11 EGFR 3354/4885ALDH1A1 755/4885PIK3CD 2693/4885
US-20260102395-A1 INHIBITING HISTONE DEACETYLASE 6 HDAC6, HDAC1, HDAC8 EGFR 2282/4885ALDH1A1 1511/4885PIK3CD 3713/4885
US-20230064443-A1 5-oxo-1,2,3,5,8,8a-hexahydroindolizine-3-carboxamide Derivatives Useful As a Factor XIa Inhibitors F11, F12, F13A1 EGFR 3047/4885ALDH1A1 2398/4885PIK3CD 2128/4885
US-11993601-B2 Monoacylglycerol lipase modulators MGLL, LPL, PNLIP EGFR 1500/4885ALDH1A1 344/4885PIK3CD 855/4885
US-11597728-B2 Monoacylglycerol lipase modulators MGLL, LPL, PNLIP EGFR 1500/4885ALDH1A1 344/4885PIK3CD 855/4885
US-20240327410-A1 Monoacylglycerol Lipase Modulators MGLL, LPL, PNLIP EGFR 1500/4885ALDH1A1 344/4885PIK3CD 855/4885
US-20220315583-A1 Monoacylglycerol Lipase Modulators MGLL, LPL, PNLIP EGFR 1500/4885ALDH1A1 344/4885PIK3CD 855/4885

“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.