SCHEMBL6286616

SCHEMBL6286616

COC(=O)Cc1c(F)ccc(N)c1F

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.45
ALDH1A1 P00352 4/20 0.45
GFER P55789 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.41
CYP4F2 P78329 1/20 0.39
CYP4A11 Q02928 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
EGFR P00533 3/20 0.37
HSP90AB1 P08238 1/20 0.37
HSD17B10 Q99714 3/20 0.37
HTT P42858 2/20 0.37
MAPT P10636 4/20 0.36
KDM4E B2RXH2 1/20 0.36
HPGD P15428 1/20 0.36
ALOX15 P16050 1/20 0.36
TSHR P16473 1/20 0.36
KMT2A Q03164 4/20 0.35
MEN1 O00255 3/20 0.35
LMNA P02545 1/20 0.34
HDAC1 Q13547 1/20 0.34

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
SCHEMBL22655985 0.87 SMN1; SMN2 (0.44) GAAALDH1A1GFERSMN1; SMN2CYP4F2
SCHEMBL6161648 0.83 MAPK1 (0.42) GAAALDH1A1SMN1; SMN2L3MBTL1HSD17B10
SCHEMBL8915526 0.83 GAA (0.40) GAAALDH1A1GFERSMN1; SMN2CYP4F2
SCHEMBL1457038 0.81 SMN1; SMN2 (0.50) GAAALDH1A1SMN1; SMN2CYP4F2CYP4A11
SCHEMBL7714693 0.81 GAA (0.44) GAAALDH1A1GFERSMN1; SMN2CYP4F2
SCHEMBL7708882 0.79 ALDH1A1 (0.45) GAAALDH1A1GFERCYP4F2CYP4A11
SCHEMBL30765545 0.79 F7 (0.40) GAAALDH1A1GFERSMN1; SMN2CYP4F2
SCHEMBL7245085 0.78 CA2 (0.36) ALDH1A1HDAC1HDAC6
SCHEMBL9985451 0.78 SMN1; SMN2 (0.56) GAAALDH1A1GFERSMN1; SMN2CYP4F2
SCHEMBL30739832 0.78 AKR1B1 (0.39) GAAALDH1A1SMN1; SMN2HSD17B10KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023239165-A1 PHENYLSULFONAMIDE DERIVATIVES, PREPARATION METHOD THEREFOR, AND PHARMACEUTICAL COMPOSITION FOR PREVENTION OR TREATMENT OF CANCER CONTAINING SAME AS ACTIVE INGREDIENT 한국화학연구원 2023-12-14 WO disclosed
WO-2023239165-A1 PHENYLSULFONAMIDE DERIVATIVES, PREPARATION METHOD THEREFOR, AND PHARMACEUTICAL COMPOSITION FOR PREVENTION OR TREATMENT OF CANCER CONTAINING SAME AS ACTIVE INGREDIENT 한국화학연구원 2023-12-14 WO disclosed
EP-4263541-A1 NEW ARYL-PYRIDO-PYRIMIDIN-ONE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2023-10-25 EP disclosed
US-20230322776-A1 NEW ARYL-PYRIDO-PYRIMIDIN-ONE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2023-10-12 US disclosed
CN-116710451-A Novel aryl-pyrido-pyrimidin-one derivatives 豪夫迈·罗氏有限公司 2023-09-05 CN disclosed
WO-2022129260-A1 NEW ARYL-PYRIDO-PYRIMIDIN-ONE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2022-06-23 WO disclosed
US-20210315869-A1 COMPOUNDS AND METHODS FOR CSK MODULATION AND INDICATIONS THEREFOR PLEXXIKON INC. 2021-10-14 US disclosed
US-20210315869-A1 COMPOUNDS AND METHODS FOR CSK MODULATION AND INDICATIONS THEREFOR PLEXXIKON INC. 2021-10-14 US disclosed
WO-2021202900-A1 1,6-NAPHTHYRIDINE COMPOUNDS AND METHODS FOR CSK MODULATION AND INDICATIONS THEREFOR PLEXXIKON INC. (US) 2021-10-07 WO disclosed
US-6852761-B2 Polycyclic aryl and heteroaryl substituted benzenes useful for selective inhibition of the coagulation cascade PHARMACIA CORPORATION (US) 2005-02-08 US disclosed
US-20040138275-A1 Polycyclic aryl and heteroaryl substituted benzenes useful for selective inhibition of the coagulation cascade PHARMACIA CORPORATION 2004-07-15 US disclosed
US-20030236231-A1 Polycyclic aryl and heteroaryl substituted benzenes useful for selective inhibition of the coagulation cascade PHARMACIA CORPORATION 2003-12-25 US disclosed
US-6660885-B2 Serine protease inhibitor PHARMACIA CORPORATION 2003-12-09 US disclosed
US-6610701-B2 For therapy and prophylaxis of blood coagulation and cardiovascular disorders MERCK & CO., INC. 2003-08-26 US disclosed
US-20020193398-A1 Thrombin inhibitors MERCK & CO., INC. 2002-12-19 US disclosed
US-20020025947-A1 Polycyclic aryl and heteroaryl substituted benzenes useful for selective inhibition of the coagulation cascade PHARMACIA CORPORATION 2002-02-28 US disclosed
WO-2001068605-A1 POLYCYCLIC ARYL AND HETEROARYL SUBSTITUTED BENZENES USEFUL FOR SELECTIVE INHIBITION OF THE COAGULATION CASCADE PHARMACIA CORPORATION (US) 2001-09-20 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 (6 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-20230322776-A1 NEW ARYL-PYRIDO-PYRIMIDIN-ONE DERIVATIVES QDPR, P2RY1, REN GAA 3127/4885ALDH1A1 377/4885GFER 3184/4885
US-20030236231-A1 Polycyclic aryl and heteroaryl substituted benzenes useful for selective inhibition of the coagulation cascade TFPI, TFPI2, PLAT GAA 1195/4885ALDH1A1 2669/4885GFER 592/4885
US-20020193398-A1 Thrombin inhibitors F2, F3, TFPI GAA 4023/4885ALDH1A1 3527/4885GFER 1613/4885
US-20210315869-A1 COMPOUNDS AND METHODS FOR CSK MODULATION AND INDICATIONS THEREFOR MC2R, SLC10A1, SLC10A2 GAA 2375/4885ALDH1A1 2544/4885GFER 3448/4885
US-20040138275-A1 Polycyclic aryl and heteroaryl substituted benzenes useful for selective inhibition of the coagulation cascade TFPI, TFPI2, PLAT GAA 1195/4885ALDH1A1 2669/4885GFER 592/4885
US-20020025947-A1 Polycyclic aryl and heteroaryl substituted benzenes useful for selective inhibition of the coagulation cascade TFPI, TFPI2, PLAT GAA 1195/4885ALDH1A1 2669/4885GFER 592/4885

“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.