SCHEMBL30905972

SCHEMBL30905972

Nc1cnccc1C(F)(F)F

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AOC1 P19801 2/20 0.43
AOC3 Q16853 2/20 0.43
GAA P10253 4/20 0.41
ALDH1A1 P00352 3/20 0.41
KDM4E B2RXH2 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
MEN1 O00255 1/20 0.41
KDM6B O15054 1/20 0.41
KDM4A O75164 1/20 0.41
MAPT P10636 1/20 0.41
THRB P10828 1/20 0.41
KMT2A Q03164 1/20 0.41
KDM4D Q6B0I6 1/20 0.41
KDM4C Q9H3R0 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
ULK1 O75385 1/20 0.38
POLB P06746 2/20 0.37
NPC1 O15118 1/20 0.37
KIF11 P52732 1/20 0.37
LMNA P02545 1/20 0.36

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
SCHEMBL971004 1.00 AOC1 (0.43) AOC1AOC3GAAALDH1A1KDM4E
SCHEMBL1143409 0.82 GAA (0.46) AOC1AOC3GAAALDH1A1KDM4E
SCHEMBL30450375 0.82 GAA (0.46) AOC1AOC3GAAALDH1A1KDM4E
SCHEMBL20772453 0.78 KIF11 (0.41) GAAALDH1A1KDM4EL3MBTL1MAPT
SCHEMBL31505115 0.77 AOC1 (0.43) AOC1AOC3GAAALDH1A1KDM4E
SCHEMBL7812435 0.77 AOC1 (0.43) AOC1AOC3GAAALDH1A1KDM4E
SCHEMBL16711070 0.77 ALDH1A1 (0.38) AOC1AOC3GAAALDH1A1KDM4E
Hydrochloric Acid SCHEMBL16702785 0.75 AOC1 (0.38) AOC1AOC3GAAALDH1A1KDM4E
SCHEMBL2145747 0.74 LOXL2 (0.43) GAAALDH1A1L3MBTL1POLBNPC1
SCHEMBL3379818 0.74 ALDH1A1 (0.42) AOC1AOC3GAAALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2026086928-A1 SARM1 MODULATORS, PREPARATIONS, AND USES THEREOF Sironax Ltd. (KY) 2026-04-30 WO disclosed
US-12410183-B2 Sars-cov2 main protease inhibitors GILEAD SCIENCES, INC. (US) 2025-09-09 US disclosed
CN-113939295-B Pyridazinones and methods of use thereof 金翅雀生物公司 2025-05-16 CN disclosed
CN-119731159-A SARS-CoV2 main proteinase inhibitor 吉利德科学公司 2025-03-28 CN disclosed
US-20250042915-A1 SARS-COV2 MAIN PROTEASE INHIBITORS GILEAD SCIENCES, INC. 2025-02-06 US disclosed
CN-119317628-A Substituted bridged ring inhibitors and preparation method and application thereof 苏州泽璟生物制药股份有限公司 2025-01-14 CN disclosed
US-12091420-B2 SARS-COV2 main protease inhibitors GILEAD SCIENCES, INC. (US) 2024-09-17 US disclosed
US-20240239807-A1 SARS-COV2 MAIN PROTEASE INHIBITORS GILEAD SCIENCES, INC. 2024-07-18 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-20250042915-A1 SARS-COV2 MAIN PROTEASE INHIBITORS ACE2, TMPRSS2, ACE AOC1 2804/4885AOC3 4150/4885GAA 180/4885
US-12091420-B2 SARS-COV2 main protease inhibitors ACE2, TMPRSS2, ACE AOC1 2804/4885AOC3 4150/4885GAA 180/4885
US-12410183-B2 Sars-cov2 main protease inhibitors ACE2, TMPRSS2, ACE AOC1 2804/4885AOC3 4150/4885GAA 180/4885
US-20240239807-A1 SARS-COV2 MAIN PROTEASE INHIBITORS ACE2, TMPRSS2, ACE AOC1 2804/4885AOC3 4150/4885GAA 180/4885

“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.