SCHEMBL22501398

SCHEMBL22501398

C=C(c1ccccn1)c1ccc2ccccc2n1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.66
▸ RAB9A P51151 4/20 0.51
▸ ALDH1A1 P00352 3/20 0.51
▸ SMN1; SMN2 Q16637 3/20 0.51
▸ NPC1 O15118 3/20 0.51
▸ NFKB1 P19838 2/20 0.51
▸ NFKB2 Q00653 2/20 0.51
▸ RELA Q04206 2/20 0.51
▸ TP53 P04637 2/20 0.51
▸ ATG4B Q9Y4P1 1/20 0.51
▸ TSHR P16473 1/20 0.51
▸ MGAM O43451 1/20 0.49
▸ PAX8 Q06710 1/20 0.48
▸ GRM5 P41594 1/20 0.47
▸ KCNH2 Q12809 1/20 0.47
▸ CNR2 P34972 2/20 0.45
▸ HDAC8 Q9BY41 1/20 0.45
▸ LMNA P02545 2/20 0.44
▸ GAA P10253 1/20 0.44
▸ MAPT P10636 1/20 0.44

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
SCHEMBL28443611 0.87 MGAM (0.61) KDM4ERAB9AALDH1A1SMN1; SMN2NPC1
SCHEMBL1408599 0.81 CES2 (0.58) KDM4ERAB9AALDH1A1SMN1; SMN2NPC1
SCHEMBL13475582 0.79 KDM4E (1.00) KDM4ERAB9AALDH1A1SMN1; SMN2NPC1
Methyl Alcohol SCHEMBL28478481 0.79 ALDH1A1 (0.58) KDM4ERAB9AALDH1A1SMN1; SMN2NPC1
SCHEMBL28605670 0.77 CNR2 (0.62) KDM4ERAB9AALDH1A1SMN1; SMN2NPC1
SCHEMBL6430262 0.76 KDM4E (0.50) KDM4ERAB9AALDH1A1SMN1; SMN2NPC1
SCHEMBL22501419 0.76 RAB9A (0.50) KDM4ERAB9AALDH1A1SMN1; SMN2NPC1
Quinoline SCHEMBL28307189 0.75 ALDH1A1 (0.57) KDM4ERAB9AALDH1A1SMN1; SMN2NPC1
SCHEMBL12256867 0.74 MGAM (0.64) KDM4ERAB9AALDH1A1SMN1; SMN2NPC1
SCHEMBL3162890 0.72 SMN1; SMN2 (0.52) KDM4ERAB9AALDH1A1SMN1; SMN2NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12479803-B2 Antimalarial compounds UNIVERSITY OF CENTRAL FLORIDA RESEARCH FOUNDATION, INC. (US) 2025-11-25 — — US disclosed
CN-111494381-B Application of alkenyl quinoline compound in preparation of antitumor drugs 南方医科大学 2023-07-28 — — CN disclosed
US-20220204452-A1 ANTIMALARIAL COMPOUNDS UNIVERSITY OF CENTRAL FLORIDA RESEARCH FOUNDATION, INC. 2022-06-30 — — US disclosed
WO-2020206252-A1 ANTIMALARIAL COMPOUNDS UNIVERSITY OF CENTRAL FLORIDA RESEARCH FOUNDATION, INC. (US) 2020-10-08 — — WO disclosed
CN-111494381-A Application of alkenyl quinoline compound in preparation of antitumor drugs 南方医科大学 2020-08-07 — — 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-12479803-B2 Antimalarial compounds H1-3, FPR3, NHERF1 KDM4E 3559/4885RAB9A 1335/4885ALDH1A1 3012/4885
US-20220204452-A1 ANTIMALARIAL COMPOUNDS H1-3, FPR3, NHERF1 KDM4E 3559/4885RAB9A 1335/4885ALDH1A1 3012/4885

“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.

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