SCHEMBL7477120

SCHEMBL7477120

CC(C)c1c(C(N)=O)ccc2ccccc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NCEH1 Q6PIU2 2/20 0.54
WDR5 P61964 1/20 0.44
IRAK4 Q9NWZ3 2/20 0.44
KMT2A Q03164 3/20 0.43
ATM Q13315 1/20 0.43
LDHA P00338 1/20 0.43
KDM4E B2RXH2 4/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
POLB P06746 1/20 0.43
ALDH1A1 P00352 2/20 0.42
GAA P10253 2/20 0.42
EPHX1 P07099 1/20 0.41
AURKA O14965 1/20 0.40
RPS6KB1 P23443 1/20 0.40
AURKB Q96GD4 1/20 0.40
MEN1 O00255 2/20 0.40
LMNA P02545 1/20 0.40
HPGD P15428 1/20 0.40
PSEN1 P49768 1/20 0.40
PSEN2 P49810 1/20 0.40

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
SCHEMBL9807649 0.84 NCEH1 (0.51) NCEH1WDR5KMT2ALDHAKDM4E
SCHEMBL23809161 0.84 WDR5 (0.59) NCEH1WDR5LDHAKDM4EALDH1A1
SCHEMBL19695770 0.83 NCEH1 (0.50) NCEH1WDR5KMT2ALDHAKDM4E
SCHEMBL2882576 0.79 IRAK4 (0.44) IRAK4KMT2AATMKDM4EPOLB
SCHEMBL12355057 0.79 NCEH1 (0.47) NCEH1WDR5KMT2ALDHAKDM4E
SCHEMBL3454172 0.79 LCK (0.45) NCEH1IRAK4KDM4ESMN1; SMN2ALDH1A1
SCHEMBL9633489 0.79 KMT2A (0.40) NCEH1WDR5KMT2AATMLDHA
SCHEMBL8609970 0.77 NCEH1 (0.44) NCEH1WDR5KMT2ALDHAKDM4E
SCHEMBL5153416 0.77 TSHR (0.50) NCEH1WDR5KMT2AATMLDHA
SCHEMBL6748668 0.76 WDR5 (0.68) WDR5KMT2AATMLDHAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1222174-A1 IMIDAZOL-4-YLMETHANOLS USED AS INHIBITORS OF STEROID C17-20 LYASE Takeda Chemical Industries, Ltd. (JP) 2002-07-17 EP claimed
WO-2001030762-A1 IMIDAZOL-4-YLMETHANOLS USE AS INHIBITORS OF STEROID C17-20 LYASE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-05-03 WO claimed
US-12103902-B2 Bicyclic compounds VIVACE THERAPEUTICS, INC. (US) 2024-10-01 US disclosed
US-20220298102-A1 BICYCLIC COMPOUNDS VIVACE THERAPEUTICS, INC. 2022-09-22 US disclosed
EP-1222174-A1 IMIDAZOL-4-YLMETHANOLS USED AS INHIBITORS OF STEROID C17-20 LYASE Takeda Chemical Industries, Ltd. (JP) 2002-07-17 EP disclosed
WO-2001030762-A1 IMIDAZOL-4-YLMETHANOLS USE AS INHIBITORS OF STEROID C17-20 LYASE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-05-03 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 (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-20220298102-A1 BICYCLIC COMPOUNDS YAP1, TEAD2, TEAD3 NCEH1 3528/4885WDR5 2209/4885IRAK4 4021/4885
US-12103902-B2 Bicyclic compounds YAP1, TEAD2, TEAD3 NCEH1 3513/4885WDR5 1789/4885IRAK4 3381/4885

“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.