SCHEMBL29625980

SCHEMBL29625980

NC(=O)c1cccc(-c2noc(C(F)(F)F)n2)c1

nearest known ligand 0.65

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 14/20 0.65
HDAC1 Q13547 11/20 0.65
HDAC8 Q9BY41 9/20 0.65
NPC1 O15118 2/20 0.60
RAB9A P51151 2/20 0.60
HDAC5 Q9UQL6 2/20 0.54
HDAC4 P56524 7/20 0.51
HDAC7 Q8WUI4 1/20 0.51
HDAC9 Q9UKV0 1/20 0.51

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
SCHEMBL29629404 1.00 HDAC6 (0.65) HDAC6HDAC1HDAC8NPC1RAB9A
SCHEMBL2224875 0.87 HDAC6 (0.59) HDAC6HDAC1HDAC8NPC1RAB9A
SCHEMBL16652875 0.85 NPC1 (0.55) HDAC6HDAC1HDAC8NPC1RAB9A
SCHEMBL19071237 0.84 HDAC6 (0.72) HDAC6HDAC1HDAC8HDAC4
SCHEMBL18824382 0.83 HDAC6 (0.59) HDAC6HDAC1HDAC8HDAC5HDAC4
SCHEMBL28499323 0.83 HDAC6 (0.51) HDAC6HDAC1HDAC8HDAC5HDAC4
SCHEMBL21806679 0.81 HDAC6 (0.58) HDAC6HDAC1HDAC8NPC1RAB9A
SCHEMBL29757333 0.80 HDAC4 (0.53) HDAC6HDAC1HDAC8HDAC5HDAC4
SCHEMBL2225015 0.80 HDAC6 (0.53) HDAC6HDAC1HDAC8HDAC5HDAC4
SCHEMBL19745693 0.79 HDAC6 (1.00) HDAC6HDAC1HDAC8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112004813-B Oxadiazole compounds for controlling phytopathogenic fungi PI工业有限公司 2024-03-29 CN claimed
CN-116283955-B Compound for targeted degradation of HDAC7, and preparation method and application thereof 浙江大学 2025-06-17 CN disclosed
US-20240246956-A1 CLASS IIA HISTONE DEACETYLASE (HDAC) DEGRADER LIGANDS AND METHODS OF USE THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2024-07-25 US disclosed
CN-112004813-B Oxadiazole compounds for controlling phytopathogenic fungi PI工业有限公司 2024-03-29 CN disclosed
EP-4333842-A1 CLASS IIA HISTONE DEACETYLASE (HDAC) DEGRADER LIGANDS AND METHODS OF USE THEREOF Dana-Farber Cancer Institute, Inc. (US) 2024-03-13 EP disclosed
CN-116283955-A Compound for targeted degradation of HDAC7, and preparation method and application thereof 浙江大学 2023-06-23 CN disclosed
CN-116253730-A PROTAC compound for targeted degradation of HDAC7 protein and preparation method and application thereof 浙江大学 2023-06-13 CN disclosed
WO-2022235565-A1 CLASS IIA HISTONE DEACETYLASE (HDAC) DEGRADER LIGANDS AND METHODS OF USE THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2022-11-10 WO disclosed
US-20220169621-A1 OXADIAZOLES FOR USE IN CONTROLLING PHYTOPATHOGENIC FUNGI PI INDUSTRIES LTD. (IN) 2022-06-02 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-20240246956-A1 CLASS IIA HISTONE DEACETYLASE (HDAC) DEGRADER LIGANDS AND METHODS OF USE THEREOF HDAC4, HDAC1, HDAC7 HDAC6 9/4885HDAC1 2/4885HDAC8 6/4885
US-20220169621-A1 OXADIAZOLES FOR USE IN CONTROLLING PHYTOPATHOGENIC FUNGI OXA1L, CYP51A1, CYP1A1 HDAC6 1374/4885HDAC1 725/4885HDAC8 2756/4885

“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.