SCHEMBL23800502

SCHEMBL23800502

OCCn1cc(I)c2cc(-c3ncn(C4CCCCO4)n3)ccc21

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CD274 Q9NZQ7 1/20 0.35
▸ RXRA P19793 1/20 0.33
▸ RXRB P28702 1/20 0.33
▸ RXRG P48443 1/20 0.33
▸ DRD2 P14416 1/20 0.31
▸ HTR2A P28223 1/20 0.31
▸ HTR1A P08908 1/20 0.31
▸ DRD4 P21917 1/20 0.31
▸ HTR1B P28222 1/20 0.31
▸ DRD3 P35462 1/20 0.31
▸ FGFR1 P11362 1/20 0.30
▸ FGFR2 P21802 1/20 0.30
▸ FGFR4 P22455 1/20 0.30
▸ FGFR3 P22607 1/20 0.30
▸ KDR P35968 1/20 0.30
▸ FLT3 P36888 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
SCHEMBL20605014 0.88 CD274 (0.34) CD274RXRARXRBRXRGDRD2
SCHEMBL20604911 0.88 CD274 (0.44) CD274HTR1ADRD4HTR1BDRD3
SCHEMBL20604966 0.85 DRD2 (0.35) CD274RXRARXRBRXRGDRD2
SCHEMBL20604926 0.77 DRD2 (0.39) DRD2HTR2AHTR1ADRD4HTR1B
SCHEMBL20605167 0.73 ASH1L (0.33) —
SCHEMBL20605098 0.72 SRC (0.44) CD274RXRARXRBRXRGKDR
SCHEMBL20604830 0.71 DYRK1A (0.35) —
SCHEMBL20605007 0.70 GLO1 (0.38) CD274RXRARXRBRXRGFGFR1
SCHEMBL2144561 0.69 ALDH1A1 (0.36) CD274RXRARXRBRXRGFLT3
SCHEMBL482277 0.69 CYP4F2 (0.36) CD274RXRARXRBRXRGFLT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12144816-B2 Substituted indole Mcl-1 inhibitors VANDERBILT UNIVERSITY (US) 2024-11-19 — — US disclosed
EP-4292662-A2 SUBSTITUTED INDOLE MCL-1 INHIBITORS Vanderbilt University (US) 2023-12-20 — — EP disclosed
US-20230330099-A1 SUBSTITUTED INDOLE MCL-1 INHIBITORS VANDERBILT UNIVERSITY 2023-10-19 — — US disclosed
EP-3423435-B1 SUBSTITUTED INDOLE MCL-1 INHIBITORS UNIV VANDERBILT (US) 2023-08-23 — — EP disclosed
US-11596639-B2 Substituted indole Mcl-1 inhibitors VANDERBILT UNIVERSITY (US) 2023-03-07 — — US disclosed
CN-109153643-B Substituted indole MCL-1 inhibitors 范德比尔特大学 2022-06-21 — — CN disclosed
US-20210283138-A1 SUBSTITUTED INDOLE MCL-1 INHIBITORS VANDERBILT UNIVERSITY 2021-09-16 — — 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 (4 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-20210283138-A1 SUBSTITUTED INDOLE MCL-1 INHIBITORS MCL1, BCL2L1, BCL9 CD274 1983/4885RXRA 4447/4885RXRB 4116/4885
US-12144816-B2 Substituted indole Mcl-1 inhibitors MCL1, BCL2L1, BCL9 CD274 1983/4885RXRA 4447/4885RXRB 4116/4885
US-20230330099-A1 SUBSTITUTED INDOLE MCL-1 INHIBITORS MCL1, BCL2L1, BCL9 CD274 1983/4885RXRA 4447/4885RXRB 4116/4885
US-11596639-B2 Substituted indole Mcl-1 inhibitors MCL1, BCL2L1, BCL9 CD274 1983/4885RXRA 4447/4885RXRB 4116/4885

“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.

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