SCHEMBL30177262

SCHEMBL30177262

CCOC(=O)CCc1ccccc1C(=O)N1CCSC[C@H]1CO

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 3/20 0.47
CYP4A11 Q02928 3/20 0.47
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
POLB P06746 1/20 0.43
ALDH1A1 P00352 3/20 0.42
TSHR P16473 1/20 0.42
GAA P10253 1/20 0.39
HCRTR2 O43614 2/20 0.38
KDM4E B2RXH2 1/20 0.36
NR1D1 P20393 1/20 0.35
LMNA P02545 3/20 0.35
GPBAR1 Q8TDU6 1/20 0.35
NOTUM Q6P988 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL25718953 1.00 CYP4F2 (0.47) CYP4F2CYP4A11MEN1KMT2APOLB
SCHEMBL23884691 0.90 MEN1 (0.39) CYP4F2CYP4A11MEN1KMT2APOLB
SCHEMBL23884841 0.85 ALDH1A1 (0.37) MEN1KMT2APOLBALDH1A1TSHR
SCHEMBL23884840 0.85 ALDH1A1 (0.37) MEN1KMT2APOLBALDH1A1TSHR
SCHEMBL30177234 0.83 HCRTR2 (0.51) CYP4F2CYP4A11MEN1KMT2APOLB
SCHEMBL25718949 0.82 CYP4F2 (0.47) CYP4F2CYP4A11MEN1KMT2APOLB
SCHEMBL30177177 0.82 CYP4F2 (0.47) CYP4F2CYP4A11MEN1KMT2APOLB
SCHEMBL23884814 0.80 MEN1 (0.35) CYP4F2CYP4A11MEN1KMT2APOLB
SCHEMBL30177225 0.80 MEN1 (0.35) CYP4F2CYP4A11MEN1KMT2APOLB
SCHEMBL30177205 0.78 MAPT (0.44) MEN1KMT2APOLBALDH1A1HCRTR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4126832-B1 MODULATORS OF HEMOGLOBIN GLOBAL BLOOD THERAPEUTICS INC (US) 2026-01-07 EP disclosed
US-20230192611-A1 MODULATORS OF HEMOGLOBIN GLOBAL BLOOD THERAPEUTICS, INC. 2023-06-22 US disclosed
EP-4126832-A1 MODULATORS OF HEMOGLOBIN Global Blood Therapeutics, Inc. (US) 2023-02-08 EP 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-20230192611-A1 MODULATORS OF HEMOGLOBIN HBG1, HBG2, HBB CYP4F2 632/4885CYP4A11 970/4885MEN1 3703/4885

“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.