SCHEMBL19959255

SCHEMBL19959255

Cc1cc(OS(=O)(=O)C(F)(F)F)c2ccccc2c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.43
CYP2A6 P11509 1/20 0.43
LMNA P02545 1/20 0.35
CETP P11597 1/20 0.35
ALDH1A1 P00352 3/20 0.35
KDM4E B2RXH2 2/20 0.35
HSD17B10 Q99714 1/20 0.35
TUBB4A P04350 1/20 0.35
TUBB P07437 1/20 0.35
TUBA3C P0DPH7 1/20 0.35
TUBA1B P68363 1/20 0.35
TUBA4A P68366 1/20 0.35
TUBB4B P68371 1/20 0.35
TUBB3 Q13509 1/20 0.35
TUBB2A Q13885 1/20 0.35
TUBB8 Q3ZCM7 1/20 0.35
TUBA3E Q6PEY2 1/20 0.35
TUBA1A Q71U36 1/20 0.35
TUBA1C Q9BQE3 1/20 0.35
TUBB6 Q9BUF5 1/20 0.35

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
SCHEMBL15998764 0.85 GPR84 (0.37) CYP1A2CYP2A6ALDH1A1KDM4E
SCHEMBL28211609 0.84 ADORA2A (0.34) CYP1A2CYP2A6ALDH1A1KDM4EHSD17B10
SCHEMBL31722992 0.84 ADORA2A (0.39) CYP1A2ALDH1A1KDM4EHSD17B10TUBB4A
SCHEMBL6937631 0.83 GPR84 (0.45) CYP1A2ALDH1A1KDM4EHSD17B10TUBB4A
SCHEMBL1408383 0.82 TUBB4A (0.45) CYP1A2CYP2A6LMNAALDH1A1KDM4E
SCHEMBL26794038 0.82 PTGDR2 (0.37) LMNACETPALDH1A1KDM4EHSD17B10
SCHEMBL30064889 0.82 TUBB4A (0.45) CYP1A2CYP2A6LMNAALDH1A1KDM4E
SCHEMBL30064989 0.82 NQO2 (0.43) CYP1A2ALDH1A1KDM4EHSD17B10HPGD
SCHEMBL15998741 0.82 HTT (0.39) LMNAALDH1A1KDM4EHSD17B10HTR6
SCHEMBL2656359 0.82 NQO2 (0.43) CYP1A2ALDH1A1KDM4EHSD17B10HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240239788-A1 SMALL MOLECULE INHIBITORS OF KRAS G12D MUTANT TAIHO PHARMACEUTICAL CO., LTD. (JP) 2024-07-18 US disclosed
US-20230373999-A1 KRAS G12C INHIBITORS MIRATI THERAPEUTICS INC (US) 2023-11-23 US disclosed
US-20230339910-A1 RAS INHIBITORS AND METHODS OF USING THE SAME JAZZ PHARMACEUTICALS IRELAND LIMITED (IE) 2023-10-26 US disclosed
US-20230279025-A1 KRAS G12D INHIBITORS ARRAY BIOPHARMA INC. 2023-09-07 US disclosed
US-11548888-B2 KRas G12C inhibitors Mirati Therapeutics, Inc. (US) 2023-01-10 US disclosed
EP-4087573-A1 KRAS G12C INHIBITORS Mirati Therapeutics, Inc. (US) 2022-11-16 EP disclosed
EP-3908283-A1 KRAS G12C INHIBITORS Mirati Therapeutics, Inc. (US) 2021-11-17 EP disclosed
US-20200331911-A1 KRAS G12C INHIBITORS Mirati Therapeutics, Inc. 2020-10-22 US disclosed
WO-2020146613-A1 KRAS G12C INHIBITORS Mirati Therapeutics, Inc. (US) 2020-07-16 WO disclosed
US-20180072723-A1 KRAS G12C INHIBITORS Mirati Therapeutics, Inc. 2018-03-15 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 (7 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-20230279025-A1 KRAS G12D INHIBITORS KRAS, NRAS, HRAS CYP1A2 4527/4885CYP2A6 3249/4885LMNA 4065/4885
US-11548888-B2 KRas G12C inhibitors KRAS, NRAS, HRAS CYP1A2 4667/4885CYP2A6 3834/4885LMNA 2991/4885
US-20240239788-A1 SMALL MOLECULE INHIBITORS OF KRAS G12D MUTANT KRAS, NRAS, HRAS CYP1A2 4576/4885CYP2A6 3523/4885LMNA 4027/4885
US-20200331911-A1 KRAS G12C INHIBITORS KRAS, NRAS, HRAS CYP1A2 4667/4885CYP2A6 3834/4885LMNA 2991/4885
US-20230339910-A1 RAS INHIBITORS AND METHODS OF USING THE SAME KRAS, NRAS, HRAS CYP1A2 4745/4885CYP2A6 4497/4885LMNA 3604/4885
US-20180072723-A1 KRAS G12C INHIBITORS KRAS, NRAS, HRAS CYP1A2 4667/4885CYP2A6 3834/4885LMNA 2991/4885
US-20230373999-A1 KRAS G12C INHIBITORS KRAS, NRAS, HRAS CYP1A2 4667/4885CYP2A6 3834/4885LMNA 2991/4885

“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.