SCHEMBL21596901

SCHEMBL21596901

COc1cc(-c2ccccn2)cc2onc(N)c12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 6/20 0.48
ALDH1A1 P00352 2/20 0.48
MAPT P10636 2/20 0.48
ERN1 O75460 1/20 0.46
RAB9A P51151 5/20 0.42
SMN1; SMN2 Q16637 4/20 0.42
PKM P14618 3/20 0.42
TP53 P04637 3/20 0.42
KDM4E B2RXH2 1/20 0.42
GAA P10253 1/20 0.42
HSD17B10 Q99714 1/20 0.42
KAT6A Q92794 4/20 0.40
KAT7 O95251 3/20 0.40
GRM5 P41594 1/20 0.40
CYP1A1 P04798 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP1B1 Q16678 1/20 0.40
POLB P06746 1/20 0.40
HSP90AA1 P07900 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL29652491 1.00 NPC1 (0.48) NPC1ALDH1A1MAPTERN1RAB9A
SCHEMBL21596793 0.82 FYN (0.44) NPC1ALDH1A1MAPTRAB9ASMN1; SMN2
SCHEMBL21596911 0.80 NPC1 (0.48) NPC1ALDH1A1MAPTERN1RAB9A
SCHEMBL31432518 0.78 KAT6A (0.38) NPC1ALDH1A1MAPTRAB9ASMN1; SMN2
SCHEMBL25564465 0.78 KAT6A (0.38) NPC1ALDH1A1MAPTRAB9ASMN1; SMN2
SCHEMBL21609118 0.77 KAT6A (0.69) KAT6AKAT7KAT6B
SCHEMBL29652588 0.77 KAT6A (0.69) KAT6AKAT7KAT6B
SCHEMBL21596906 0.75 GLRA3 (0.36) NPC1ALDH1A1MAPTSMN1; SMN2TP53
SCHEMBL29652439 0.74 KDR (0.56) ALDH1A1MAPTGAA
SCHEMBL21596867 0.74 KDR (0.56) ALDH1A1MAPTGAA

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
US-20260062393-A1 Compounds CTXT PTY LTD (AU) 2026-03-05 US disclosed
US-12365655-B2 Compounds CTXT PTY LTD (AU) 2025-07-22 US disclosed
EP-4335439-A2 COMPOUNDS CTXT PTY LTD (AU) 2024-03-13 EP disclosed
EP-3810602-B1 COMPOUNDS CTXT PTY LTD (AU) 2023-11-01 EP disclosed
EP-3810602-B1 COMPOUNDS CTXT PTY LTD (AU) 2023-11-01 EP disclosed
US-20220153710-A1 Compounds CTXT PTY LTD (AU) 2022-05-19 US disclosed
US-20220153710-A1 Compounds CTXT PTY LTD (AU) 2022-05-19 US disclosed
EP-3810602-A1 COMPOUNDS CTXT Pty Limited (AU) 2021-04-28 EP disclosed
CN-112334466-A Compound (I) CTXT私人有限公司 2021-02-05 CN disclosed
US-20200039945-A1 Compounds CTXT PTY LIMITED (AU) 2020-02-06 US disclosed
US-20200039945-A1 Compounds CTXT PTY LIMITED (AU) 2020-02-06 US disclosed
WO-2019243491-A1 COMPOUNDS CTXT PTY LIMITED (AU) 2019-12-26 WO disclosed
WO-2019243491-A1 COMPOUNDS CTXT PTY LIMITED (AU) 2019-12-26 WO 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-20220153710-A1 Compounds SLC10A1, ABCB11, PCSK9 NPC1 28/4885ALDH1A1 981/4885MAPT 1135/4885
US-20200039945-A1 Compounds SLC10A1, ABCB11, PCSK9 NPC1 28/4885ALDH1A1 982/4885MAPT 1136/4885
US-20260062393-A1 Compounds SCN2B, ABCB11, SCN1B NPC1 10/4885ALDH1A1 1864/4885MAPT 2629/4885
US-12365655-B2 Compounds SLC10A1, ABCB11, PCSK9 NPC1 28/4885ALDH1A1 982/4885MAPT 1136/4885

“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.