SCHEMBL25713293

SCHEMBL25713293

O=C(O)C1(Cc2ccc(F)cc2)CCCCC1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 3/20 0.49
CYP2C19 P33261 1/20 0.44
ALDH1A1 P00352 3/20 0.41
PPARG P37231 1/20 0.40
PPARA Q07869 1/20 0.40
ALOX5AP P20292 1/20 0.39
MME P08473 1/20 0.39
SLC6A3 Q01959 1/20 0.39
ADRB2 P07550 2/20 0.38
CNR1 P21554 1/20 0.38
CNR2 P34972 1/20 0.38
POLB P06746 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HTT P42858 1/20 0.38
CTBP2 P56545 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
SCHEMBL9314436 0.91 CYP4F2 (0.41) HSD11B1ALDH1A1POLBRAB9AHTT
SCHEMBL6585961 0.84 CYP2C19 (0.48) CYP2C19ALDH1A1PPARGPPARASLC6A3
SCHEMBL11373445 0.84 CYP2C19 (0.48) CYP2C19ALDH1A1PPARGPPARASLC6A3
SCHEMBL29024354 0.84 CYP2C19 (0.48) CYP2C19ALDH1A1PPARGPPARASLC6A3
SCHEMBL22549674 0.83 HSD11B1 (0.43) HSD11B1ALDH1A1MMESLC6A3POLB
SCHEMBL28840772 0.83 MME (0.46) CYP2C19ALDH1A1PPARGPPARAALOX5AP
Hydrochloric Acid SCHEMBL5807511 0.82 SLC6A2 (0.42) HSD11B1SLC6A3CNR2
SCHEMBL5818358 0.82 AKR1C1 (0.47) CYP2C19ALDH1A1SLC6A3ADRB2RAB9A
SCHEMBL22549561 0.81 HSD11B1 (0.41) HSD11B1ALDH1A1MMEPOLB
SCHEMBL24663644 0.81 HSD11B1 (0.41) HSD11B1ALDH1A1MMEHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11685748-B2 Spiro aromatic ring compound and application thereof ETERN BIOPHARMA (SHANGHAI) CO., LTD. (CN) 2023-06-27 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 (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-11685748-B2 Spiro aromatic ring compound and application thereof PTPN1, PTPN11, PTPN5 HSD11B1 257/4885CYP2C19 1114/4885ALDH1A1 1919/4885

“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.