SCHEMBL6375671

SCHEMBL6375671

COc1ccc(N(F)S(=O)(=O)c2cc(F)c(F)c(F)c2F)cc1F

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 2/20 0.43
TUBB1 Q9H4B7 3/20 0.42
TUBB4A P04350 1/20 0.40
TUBB P07437 1/20 0.40
TUBA3C P0DPH7 1/20 0.40
CES1 P23141 1/20 0.40
TUBA1B P68363 1/20 0.40
TUBA4A P68366 1/20 0.40
TUBB4B P68371 1/20 0.40
TUBB3 Q13509 1/20 0.40
TUBB2A Q13885 1/20 0.40
TUBB8 Q3ZCM7 1/20 0.40
TUBA3E Q6PEY2 1/20 0.40
TUBA1A Q71U36 1/20 0.40
TUBA1C Q9BQE3 1/20 0.40
TUBB6 Q9BUF5 1/20 0.40
TUBB2B Q9BVA1 1/20 0.40
KDM4E B2RXH2 1/20 0.38
ATM Q13315 1/20 0.38
HDAC6 Q9UBN7 3/20 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
SCHEMBL7099461 0.88 TUBB1 (0.45) HDAC8TUBB1KDM4EATMHDAC6
SCHEMBL7100378 0.83 HDAC8 (0.42) HDAC8KDM4EATMHDAC6HDAC2
SCHEMBL28762088 0.79 HDAC8 (0.40) HDAC8TUBB1TUBB4ATUBBTUBA3C
SCHEMBL6087582 0.79 HDAC6 (0.38) HDAC8HDAC6MAPK1RAB9AHDAC2
SCHEMBL27528600 0.78 TUBB4A (0.47) TUBB1TUBB4ATUBBTUBA3CCES1
SCHEMBL22909519 0.78 TAS2R14 (0.48) HDAC8HDAC6LMNAHDAC2KMT2A
SCHEMBL29671306 0.78 TAS2R14 (0.48) HDAC8HDAC6LMNAHDAC2KMT2A
SCHEMBL7535728 0.74 TUBB1 (0.50) TUBB1LMNAMAPK1HTTRAB9A
SCHEMBL6086580 0.73 TUBB1 (0.45) TUBB1TUBB4ATUBBTUBA3CCES1
SCHEMBL30150631 0.73 TUBB1 (0.45) TUBB1TUBB4ATUBBTUBA3CCES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111253336-B Compounds for the treatment of cancer GTX公司 2023-11-21 CN disclosed
CN-106794174-B Compounds for the treatment of cancer GTX公司 2021-03-12 CN disclosed
EP-3708164-A1 COMPOUNDS FOR TREATMENT OF CANCER Oncternal Therapeutics, Inc (US) 2020-09-16 EP disclosed
EP-3139919-B1 COMPOUNDS FOR TREATMENT OF CANCER ONCTERNAL THERAPEUTICS INC (US) 2020-06-03 EP disclosed
US-10155728-B2 Compounds for treatment of cancer GTX INC. (US) 2018-12-18 US disclosed
US-9981915-B2 Compounds for treatment of cancer UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION (US) 2018-05-29 US disclosed
US-20180118693-A1 COMPOUNDS FOR TREATMENT OF CANCER GTX, INC. (US) 2018-05-03 US disclosed
US-20170057930-A1 COMPOUNDS FOR TREATMENT OF CANCER GTX, INC. (US) 2017-03-02 US disclosed
EP-1206256-B8 COMBINATION THERAPY USING PENTAFLUOROBENZENESULFONAMIDE AND PLATIN COMPOUND AMGEN INC (US) 2005-06-29 EP disclosed
EP-1206256-B1 COMBINATION THERAPY USING PENTAFLUOROBENZENESULFONAMIDE AND PLATIN COMPOUND TULARIK INC (US) 2005-05-04 EP disclosed
EP-1206256-A2 COMBINATION THERAPY USING PENTAFLUOROBENZENESULFONAMIDE AND PLATIN COMPOUND Tularik Inc. (US) 2002-05-22 EP disclosed
US-6355628-B1 Such as 2-Fluoro-1-methoxy-4-pentafluorophenylsulfonamidobenzene (batabulin) with antineoplastic platinum coordination complex such as cisplatin TULARIK INC. 2002-03-12 US disclosed
WO-2001008693-A2 COMBINATION THERAPY USING PENTAFLUOROBENZENESULFONAMIDE AND PLATIN COMPOUND TULARIK INC. (US) 2001-02-08 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 (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-10155728-B2 Compounds for treatment of cancer TP53, TUBB1, TUBB6 HDAC8 903/4885TUBB1 2/4885TUBB4A 7/4885
US-20180118693-A1 COMPOUNDS FOR TREATMENT OF CANCER TP53, TUBB1, TUBB6 HDAC8 903/4885TUBB1 2/4885TUBB4A 7/4885
US-20170057930-A1 COMPOUNDS FOR TREATMENT OF CANCER TP53, TUBB1, TUBB6 HDAC8 903/4885TUBB1 2/4885TUBB4A 7/4885

“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.