SCHEMBL26614960

SCHEMBL26614960

O=C(O)N1CC[C@H](Nc2nnc(Cl)c3ccccc23)C1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.44
HSD17B10 Q99714 1/20 0.44
SPR P35270 1/20 0.42
GOT1 P17174 1/20 0.41
KAT2B Q92831 2/20 0.41
BTK Q06187 4/20 0.40
ADORA3 P0DMS8 1/20 0.39
HTR2A P28223 1/20 0.39
ADORA2A P29274 1/20 0.39
ADORA1 P30542 1/20 0.39
SLC6A4 P31645 1/20 0.39
OPRK1 P41145 1/20 0.39
MAPT P10636 3/20 0.39
ALDH1A1 P00352 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
HPGD P15428 1/20 0.39
PDE4D Q08499 1/20 0.39
CHEK2 O96017 1/20 0.39
PAK1 Q13153 2/20 0.39
MEN1 O00255 1/20 0.38

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
SCHEMBL26614967 1.00 KDM4E (0.44) KDM4EHSD17B10SPRGOT1KAT2B
SCHEMBL25300783 0.93 KDM4E (0.49) KDM4EHSD17B10GOT1KAT2BBTK
SCHEMBL25300784 0.93 KDM4E (0.49) KDM4EHSD17B10GOT1KAT2BBTK
SCHEMBL26615096 0.85 KAT2B (0.40) SPRKAT2BBTKALDH1A1PAK1
SCHEMBL26615051 0.85 JAK2 (0.39) SPRKAT2BADORA3HTR2AADORA2A
SCHEMBL26615092 0.85 KAT2B (0.40) SPRKAT2BBTKALDH1A1PAK1
SCHEMBL26615059 0.85 JAK2 (0.39) SPRKAT2BADORA3HTR2AADORA2A
SCHEMBL30639820 0.83 BTK (0.54) BTKMAPTALDH1A1RAB9ACNR1
SCHEMBL29131857 0.83 BTK (0.54) BTKMAPTALDH1A1RAB9ACNR1
SCHEMBL29131856 0.83 BTK (0.54) BTKMAPTALDH1A1RAB9ACNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240116926-A1 HETEROAROMATIC COMPOUNDS ASTRAZENECA AB (SE) 2024-04-11 US disclosed
WO-2023209086-A1 BICYCLIC HETEROAROMATIC COMPOUNDS FOR TREATING CANCER ASTRAZENECA AB (SE) 2023-11-02 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 (1 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-20240116926-A1 HETEROAROMATIC COMPOUNDS CYP1B1, CYP2D6, CYP1A1 KDM4E 2712/4885HSD17B10 217/4885SPR 3228/4885

“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.