SCHEMBL22116166

SCHEMBL22116166

Cc1ccc(OCC2COC(C)(C)N2C(=O)OC(C)(C)C)c(C)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.41
SPHK1 Q9NYA1 1/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
BRD4 O60885 1/20 0.38
RAB9A P51151 2/20 0.38
MAPT P10636 2/20 0.38
HPGD P15428 3/20 0.38
KDM4E B2RXH2 2/20 0.38
NPC1 O15118 1/20 0.38
GLA P06280 1/20 0.38
LMNA P02545 4/20 0.37
GAA P10253 1/20 0.37
ALDH1A1 P00352 2/20 0.36
VDR P11473 1/20 0.36
HSP90AA1 P07900 1/20 0.36
UBE2N P61088 1/20 0.36
NPSR1 Q6W5P4 2/20 0.35
HSD11B2 P80365 1/20 0.35

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
SCHEMBL30308963 1.00 HTT (0.41) HTTSPHK1MEN1KMT2ASMN1; SMN2
SCHEMBL8945204 0.80 HTR2C (0.38) SPHK1BRD4MAPTLMNAHSD11B2
SCHEMBL19357528 0.79 SPHK1 (0.44) SPHK1MEN1KMT2ABRD4KDM4E
SCHEMBL3612715 0.79 SPHK1 (0.44) SPHK1MEN1KMT2ABRD4KDM4E
SCHEMBL3612721 0.79 SPHK1 (0.44) SPHK1MEN1KMT2ABRD4KDM4E
SCHEMBL5153927 0.79 HDAC6 (0.46) VDR
SCHEMBL5153921 0.79 HDAC6 (0.46) VDR
SCHEMBL5155878 0.79 HDAC6 (0.46) VDR
SCHEMBL5155874 0.79 HDAC6 (0.46) VDR
SCHEMBL4346843 0.79 SPHK1 (0.40) SPHK1MEN1KMT2ABRD4MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260137083-A1 HETEROCYCLYL PYRIDAZINE AS FUNGICIDAL COMPOUNDS BAYER AKTIENGESELLSCHAFT (DE) 2026-05-21 US disclosed
US-12501900-B2 Heterocyclyl pyridazine as fungicidal compounds BAYER AKTIENGESELLSCHAFT (DE) 2025-12-23 US disclosed
US-20240016152-A1 ACTIVE COMPOUND COMBINATIONS BAYER AKTIENGESELLSCHAFT (DE) 2024-01-18 US disclosed
EP-4167740-A1 ACTIVE COMPOUND COMBINATIONS Bayer Aktiengesellschaft (DE) 2023-04-26 EP disclosed
CN-115955916-A Active compound combinations 拜耳公司 2023-04-11 CN disclosed
US-20230064576-A1 HETEROCYCLYL PYRIDAZINE AS FUNGICIDAL COMPOUNDS BAYER AKTIENGESELLSCHAFT (DE) 2023-03-02 US disclosed
WO-2021255070-A1 ACTIVE COMPOUND COMBINATIONS BAYER AKTIENGESELLSCHAFT (DE) 2021-12-23 WO disclosed
EP-3898620-A1 HETEROCYCLYL PYRIDAZINE AS FUNGICIDAL COMPOUNDS Bayer Aktiengesellschaft (DE) 2021-10-27 EP disclosed
CN-113454079-A Heterocyclylpyridazines as fungicidal compounds 拜耳公司 2021-09-28 CN disclosed
WO-2020127780-A1 HETEROCYCLYL PYRIDAZINE AS FUNGICIDAL COMPOUNDS BAYER AKTIENGESELLSCHAFT (DE) 2020-06-25 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-20240016152-A1 ACTIVE COMPOUND COMBINATIONS CYP51A1, ERG28, BROX HTT 4137/4885SPHK1 2745/4885MEN1 286/4885
US-20230064576-A1 HETEROCYCLYL PYRIDAZINE AS FUNGICIDAL COMPOUNDS PNPO, PDXK, BLVRB HTT 2584/4885SPHK1 1260/4885MEN1 3027/4885
US-12501900-B2 Heterocyclyl pyridazine as fungicidal compounds PNPO, PDXK, BLVRB HTT 2584/4885SPHK1 1260/4885MEN1 3027/4885
US-20260137083-A1 HETEROCYCLYL PYRIDAZINE AS FUNGICIDAL COMPOUNDS CBR1, CBR3, CYC1 HTT 4213/4885SPHK1 978/4885MEN1 2137/4885

“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.