SCHEMBL21585246

SCHEMBL21585246

O=C(c1ccccc1)c1ccc(S(F)(F)(F)(F)F)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.61
▸ SRD5A2 P31213 2/20 0.58
▸ L3MBTL1 Q9Y468 3/20 0.52
▸ ATM Q13315 1/20 0.52
▸ TDP1 Q9NUW8 1/20 0.52
▸ RAB9A P51151 6/20 0.50
▸ MEN1 O00255 4/20 0.50
▸ KMT2A Q03164 4/20 0.50
▸ LMNA P02545 2/20 0.50
▸ MAPT P10636 2/20 0.50
▸ MAPK13 O15264 1/20 0.50
▸ MAPK12 P53778 1/20 0.50
▸ MAPK11 Q15759 1/20 0.50
▸ MAPK14 Q16539 1/20 0.50
▸ AKR1C3 P42330 2/20 0.49
▸ AKR1C2 P52895 2/20 0.49
▸ NPC1 O15118 5/20 0.48
▸ HPGD P15428 3/20 0.48
▸ ELANE P08246 1/20 0.47
▸ CES2 O00748 1/20 0.46

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
SCHEMBL23430509 0.83 ALDH1A1 (0.56) ALDH1A1SRD5A2L3MBTL1ATMTDP1
SCHEMBL314267 0.81 ALDH1A1 (0.93) ALDH1A1SRD5A2L3MBTL1ATMTDP1
SCHEMBL9066312 0.81 ALDH1A1 (0.93) ALDH1A1SRD5A2L3MBTL1ATMTDP1
SCHEMBL1194001 0.79 TSHR (0.60) ALDH1A1SRD5A2AKR1C3AKR1C2CES2
Benzophenone SCHEMBL1074283 0.78 ALDH1A1 (1.00) ALDH1A1SRD5A2L3MBTL1ATMTDP1
Benzophenone SCHEMBL30537001 0.78 ALDH1A1 (1.00) ALDH1A1SRD5A2L3MBTL1ATMTDP1
Benzophenone SCHEMBL28491203 0.78 ALDH1A1 (1.00) ALDH1A1SRD5A2L3MBTL1ATMTDP1
Benzophenone SCHEMBL28180817 0.78 ALDH1A1 (1.00) ALDH1A1SRD5A2L3MBTL1ATMTDP1
Benzophenone SCHEMBL6061130 0.78 ALDH1A1 (1.00) ALDH1A1SRD5A2L3MBTL1ATMTDP1
Benzophenone SCHEMBL30536983 0.78 ALDH1A1 (1.00) ALDH1A1SRD5A2L3MBTL1ATMTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4678632-A1 METHOD FOR PRODUCING ARYL COMPOUND CONTAINING TRITYLSULFANYL GROUP AGC Inc. (JP) 2026-01-14 — — EP disclosed
US-20250346557-A1 METHOD FOR PRODUCING ARYL COMPOUND CONTAINING TRITYLSULFANYL GROUP AGC Inc. (JP) 2025-11-13 — — US disclosed
WO-2024185814-A1 METHOD FOR PRODUCING ARYL COMPOUND CONTAINING TRITYLSULFANYL GROUP AGC株式会社 2024-09-12 — — WO disclosed
US-20210163408-A1 METHOD FOR PREPARING A POLYFLUORINATED COMPOUND ETH ZURICH (CH) 2021-06-03 — — US disclosed
WO-2019229103-A1 METHOD FOR PREPARING A POLYFLUORINATED COMPOUND ETH ZURICH (CH) 2019-12-05 — — 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-20250346557-A1 METHOD FOR PRODUCING ARYL COMPOUND CONTAINING TRITYLSULFANYL GROUP STS, TST, CYP3A5 ALDH1A1 358/4885SRD5A2 60/4885L3MBTL1 2574/4885
US-20210163408-A1 METHOD FOR PREPARING A POLYFLUORINATED COMPOUND AFF4, AR, AFF2 ALDH1A1 4317/4885SRD5A2 81/4885L3MBTL1 3072/4885

“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.

Send feedback