SCHEMBL26412175

SCHEMBL26412175

COC(=O)c1cc(C=Cc2cc(O[Si](c3ccccc3)(c3ccccc3)C(C)(C)C)c3c(F)cccc3c2)n(C)n1

nearest known ligand 0.32

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.32
KDM4E B2RXH2 3/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CYP1A2 P05177 2/20 0.32
CYP2C19 P33261 2/20 0.32
HSD17B10 Q99714 2/20 0.32
NPC1 O15118 1/20 0.32
POLB P06746 1/20 0.32
RAB9A P51151 1/20 0.32
CYP2C9 P11712 1/20 0.32
APP P05067 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 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
SCHEMBL26020287 0.87 HSD17B10 (0.34) ALDH1A1KDM4ESMN1; SMN2CYP1A2CYP2C19
SCHEMBL25934600 0.85 HSD17B10 (0.34) ALDH1A1KDM4ESMN1; SMN2CYP1A2CYP2C19
SCHEMBL26020502 0.84 CYP1A2 (0.34) ALDH1A1KDM4ESMN1; SMN2CYP1A2CYP2C19
SCHEMBL26412177 0.84 APP (0.30) APPMAPT
SCHEMBL26412339 0.82 HSD17B10 (0.34) ALDH1A1KDM4ESMN1; SMN2CYP1A2CYP2C19
SCHEMBL26412453 0.81 CYP1A2 (0.33) CYP1A2CYP2C19HSD17B10NPC1POLB
SCHEMBL26412172 0.76 PTGER4 (0.31) ALDH1A1
SCHEMBL26020290 0.70 APP (0.32) APPMAPT
SCHEMBL26412165 0.69 PTPN11 (0.40) ALDH1A1KDM4ECYP1A2HSD17B10HPGD
SCHEMBL26412167 0.68 CYP4F2 (0.31)

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-20230130109-A1 MACROCYCLIC INDOLE DERIVATIVES AS INHIBITORS OF MCL-1 JANSSEN PHARMACEUTICA NV (BE) 2023-04-27 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-20230130109-A1 MACROCYCLIC INDOLE DERIVATIVES AS INHIBITORS OF MCL-1 MCL1, BCL2L1, BAK1 ALDH1A1 1067/4885KDM4E 1710/4885SMN1; SMN2 2915/4885

“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.