SCHEMBL25934600

SCHEMBL25934600

COC(=O)c1cc(C=Cc2cc(O[Si](c3ccccc3)(c3ccccc3)C(C)(C)C)c3ccc(F)cc3c2)n(C)n1

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2C19 P33261 1/20 0.34
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NPC1 O15118 1/20 0.32
POLB P06746 1/20 0.32
RAB9A P51151 1/20 0.32
PLA2G2A P14555 3/20 0.32
APP P05067 1/20 0.31
MAPT P10636 1/20 0.31
DHODH Q02127 1/20 0.30
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 0.91 HSD17B10 (0.34) HSD17B10CYP1A2CYP2C19KDM4EALDH1A1
SCHEMBL26412339 0.90 HSD17B10 (0.34) HSD17B10CYP1A2CYP2C19KDM4EALDH1A1
SCHEMBL26020502 0.88 CYP1A2 (0.34) HSD17B10CYP1A2CYP2C19KDM4EALDH1A1
SCHEMBL26412453 0.85 CYP1A2 (0.33) HSD17B10CYP1A2CYP2C19NPC1POLB
SCHEMBL26412175 0.85 ALDH1A1 (0.32) HSD17B10CYP1A2CYP2C19KDM4EALDH1A1
SCHEMBL25877376 0.85
SCHEMBL26020428 0.85
SCHEMBL25877378 0.85
SCHEMBL26412178 0.84 APP (0.30) APPMAPT
SCHEMBL25934603 0.81 PLA2G2A (0.38) HSD17B10KDM4EALDH1A1SMN1; SMN2PLA2G2A

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
US-20230265105-A1 MACROCYCLIC 7-PYRAZOL-5-YL-INDOLE DERIVATIVES AS INHIBITORS OF MCL-1 JANSSEN PHARMACEUTICA NV (BE) 2023-08-24 US disclosed
US-20230250109-A1 MACROCYCLIC ETHER CONTAINING INDOLE DERIVATIVES AS INHIBITORS OF MCL-1 JANSSEN PHARMACEUTICA NV (BE) 2023-08-10 US disclosed
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 (3 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-20230265105-A1 MACROCYCLIC 7-PYRAZOL-5-YL-INDOLE DERIVATIVES AS INHIBITORS OF MCL-1 MCL1, BAK1, API5 HSD17B10 4230/4885CYP1A2 3775/4885CYP2C19 4083/4885
US-20230250109-A1 MACROCYCLIC ETHER CONTAINING INDOLE DERIVATIVES AS INHIBITORS OF MCL-1 MCL1, BAK1, BCL2L1 HSD17B10 3605/4885CYP1A2 3285/4885CYP2C19 3880/4885
US-20230130109-A1 MACROCYCLIC INDOLE DERIVATIVES AS INHIBITORS OF MCL-1 MCL1, BCL2L1, BAK1 HSD17B10 3902/4885CYP1A2 3669/4885CYP2C19 4208/4885

“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.