SCHEMBL21115549

SCHEMBL21115549

CSc1cc(F)c(C)c(F)c1

nearest known ligand 0.37

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37

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
SCHEMBL3025702 0.84 HDAC1 (0.31) HDAC1HDAC6
SCHEMBL22733430 0.80 CYP1A1 (0.35)
SCHEMBL20079466 0.80 CES2 (0.36)
SCHEMBL4126746 0.80 HDAC1 (0.38) HDAC1HDAC6
SCHEMBL4126836 0.80 HDAC1 (0.38) HDAC1HDAC6
SCHEMBL12410554 0.78
SCHEMBL20067997 0.76 VRK1 (0.35)
SCHEMBL26081827 0.74 CA1 (0.37)
SCHEMBL23773233 0.72 AKR1C3 (0.30)
SCHEMBL21718866 0.72

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
WO-2024028243-A1 PYRAZOLO PESTICIDAL COMPOUNDS BASF SE (DE) 2024-02-08 WO disclosed
EP-3636636-B1 PYRIDONE COMPOUND AND AGRICULTURAL AND HORTICULTURAL FUNGICIDE MITSUI CHEMICALS AGRO INC (JP) 2022-07-06 EP disclosed
WO-2021180107-A1 COMPOUNDS USEFUL AS KINASE INHIBITORS FOCHON PHARMACEUTICALS, LTD. (CN) 2021-09-16 WO disclosed
US-10815237-B2 Antimicrobials and methods of making and using same BioVersys AG (CH) 2020-10-27 US disclosed
EP-3611165-A1 PYRIDONE COMPOUND, AND AGRICULTURAL AND HORTICULTURAL FUNGICIDE HAVING THIS AS ACTIVE COMPONENT Mitsui Chemicals Agro, Inc. (JP) 2020-02-19 EP disclosed
US-20190194205-A1 ANTIMICROBIALS AND METHODS OF MAKING AND USING SAME MELINTA THERAPEUTICS, INC. 2019-06-27 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 (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-20190194205-A1 ANTIMICROBIALS AND METHODS OF MAKING AND USING SAME LPO, OAT, MPO HDAC1 3607/4885HDAC6 729/4885
US-10815237-B2 Antimicrobials and methods of making and using same LPO, OAT, MPO HDAC1 3607/4885HDAC6 729/4885

“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.