SCHEMBL24253734

SCHEMBL24253734

Nc1nc(O)cc(C(F)(F)C(F)(F)F)n1

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 1/20 0.41
HSP90AB1 P08238 1/20 0.41
KDM4E B2RXH2 5/20 0.36
HSD17B10 Q99714 3/20 0.36
ALDH1A1 P00352 1/20 0.34
GRM4 Q14833 1/20 0.33
PTGS2 P35354 1/20 0.31
NPC1 O15118 1/20 0.30

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
SCHEMBL1143614 0.83 HSP90AA1 (0.59) HSP90AA1HSP90AB1KDM4EHSD17B10ALDH1A1
SCHEMBL24253890 0.80 HSP90AA1 (0.46) HSP90AA1HSP90AB1KDM4EHSD17B10ALDH1A1
SCHEMBL24253741 0.77 TSHR (0.39) HSP90AA1HSP90AB1KDM4EHSD17B10ALDH1A1
SCHEMBL24253736 0.76 HSP90AB1 (0.41) HSP90AA1HSP90AB1KDM4EHSD17B10ALDH1A1
SCHEMBL19711969 0.76
SCHEMBL3188969 0.75 HSD17B10 (0.55) HSP90AA1HSP90AB1KDM4EHSD17B10
SCHEMBL29546940 0.75 NPC1 (0.37) HSP90AA1HSP90AB1HSD17B10NPC1
SCHEMBL95816 0.72
SCHEMBL24253744 0.72
SCHEMBL29287591 0.71 KDM4E (0.48) HSP90AA1HSP90AB1KDM4EHSD17B10ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11708366-B2 Heteroaryl substituted spiropiperidinyl derivatives and pharmaceutical uses thereof NOVARTIS AG (CH) 2023-07-25 US disclosed
EP-4196478-A1 HETEROARYL SUBSTITUTED SPIROPIPERIDINYL DERIVATIVES AND PHARMACEUTICAL USES THEREOF Novartis AG (CH) 2023-06-21 EP disclosed
CN-116157404-A Heteroaryl substituted spiropiperidinyl derivatives and pharmaceutical uses thereof 诺华股份有限公司 2023-05-23 CN disclosed
US-20220048909-A1 HETEROARYL SUBSTITUTED SPIROPIPERIDINYL DERIVATIVES AND PHARMACEUTICAL USES THEREOF NOVARTIS INSTITUTES FOR BIOMEDICAL RESEARCH, INC. 2022-02-17 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 (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-11708366-B2 Heteroaryl substituted spiropiperidinyl derivatives and pharmaceutical uses thereof REN, NR3C2, PKD1 HSP90AA1 2357/4885HSP90AB1 2143/4885KDM4E 2714/4885
US-20220048909-A1 HETEROARYL SUBSTITUTED SPIROPIPERIDINYL DERIVATIVES AND PHARMACEUTICAL USES THEREOF REN, NR3C2, PKD1 HSP90AA1 2357/4885HSP90AB1 2143/4885KDM4E 2714/4885

“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.