SCHEMBL6192201

SCHEMBL6192201

CC(=O)c1c(F)cc(N)cc1F

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.39
MEN1 O00255 2/20 0.39
CYP3A4 P08684 1/20 0.39
HPGD P15428 1/20 0.39
THRB P10828 2/20 0.34
HDAC1 Q13547 3/20 0.33
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
CA4 P22748 2/20 0.33
HDAC6 Q9UBN7 1/20 0.33
KDM4E B2RXH2 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
NPC1 O15118 1/20 0.32
MAPT P10636 1/20 0.32
RAB9A P51151 1/20 0.32
ALDH1A1 P00352 2/20 0.32
TSHR P16473 1/20 0.32
MTOR P42345 1/20 0.32
CISD2 Q8N5K1 1/20 0.32
TP53 P04637 1/20 0.32

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
SCHEMBL14992607 0.87 THRB (0.38) KMT2AMEN1CYP3A4HPGDTHRB
SCHEMBL8583 0.80 CES2 (0.44) KMT2AMEN1CYP3A4HPGDTHRB
SCHEMBL6192702 0.78 CYP3A4 (0.41) KMT2AMEN1CYP3A4HPGDTHRB
SCHEMBL10148203 0.78 CYP3A4 (0.58) KMT2AMEN1CYP3A4HPGDTHRB
SCHEMBL4262805 0.78 DGAT1 (0.38) KMT2AMEN1CYP3A4HDAC1CA1
SCHEMBL614717 0.78 MEN1 (0.39) KMT2AMEN1CYP3A4HPGDTHRB
SCHEMBL1351105 0.76 DGAT1 (0.41) KMT2AMEN1CYP3A4HPGDTHRB
Hydrochloric Acid SCHEMBL17629791 0.76 DGAT1 (0.36) KMT2AMEN1CYP3A4THRBHDAC1
SCHEMBL3028979 0.76 NPC1 (0.41) KMT2AMEN1CYP3A4HPGDTHRB
SCHEMBL1349847 0.76 MEN1 (0.39) KMT2AMEN1CYP3A4HPGDTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1594866-A1 ANTIPROLIFERATIVE 2-(SULFO-PHENYL)-AMINOTHIAZOLE DERIVATIVES PFIZER INC. (US) 2005-11-16 EP disclosed
US-20040176431-A1 Antiproliferative 2-(sulfo-phenyl)-aminothiazole derivatives and pharmaceutical compositions, and methods for their use PFIZER, INC. 2004-09-09 US disclosed
WO-2004072070-A1 ANTIPROLIFERATIVE 2-(SULFO-PHENYL)-AMINOTHIAZOLE DERIVATIVES PFIZER INC. (US) 2004-08-26 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 (1 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-20040176431-A1 Antiproliferative 2-(sulfo-phenyl)-aminothiazole derivatives and pharmaceutical compositions, and methods for their use MKI67, TK1, CDK2 KMT2A 1183/4885MEN1 2650/4885CYP3A4 2408/4885

“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.