SCHEMBL6296986

SCHEMBL6296986

CCCCCC1(C(F)(F)F)c2cc(F)ccc2Nc2c1cc[nH]c2=O

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 3/20 0.35
CYP1A2 P05177 1/20 0.32
MAPT P10636 1/20 0.32
CYP2C19 P33261 1/20 0.32
KMT2A Q03164 1/20 0.32
AKR1B1 P15121 3/20 0.31
GPR84 Q9NQS5 1/20 0.31
GHSR Q92847 1/20 0.31
SLC10A2 Q12908 1/20 0.31
JAK2 O60674 2/20 0.30
KCNH2 Q12809 1/20 0.30

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
SCHEMBL1152307 0.97 HTR7 (0.33) HTR7CYP1A2MAPTCYP2C19KMT2A
SCHEMBL1152556 0.92 CYP1A2 (0.33) HTR7CYP1A2MAPTCYP2C19KMT2A
SCHEMBL1152893 0.89 HTR7 (0.33) HTR7CYP1A2MAPTCYP2C19KMT2A
SCHEMBL1152812 0.87 CNR2 (0.35) MAPTJAK2KCNH2
SCHEMBL6295433 0.85 JAK2 (0.32) CYP1A2MAPTCYP2C19KMT2AAKR1B1
SCHEMBL1152030 0.85 MPO (0.33) HTR7CYP1A2MAPTCYP2C19KMT2A
SCHEMBL1153156 0.85 MMP14 (0.34) HTR7CYP1A2MAPTCYP2C19KMT2A
SCHEMBL1153323 0.85 MPO (0.33) HTR7CYP1A2MAPTCYP2C19KMT2A
SCHEMBL1152499 0.84 MAPT (0.34) CYP1A2MAPTCYP2C19KMT2A
SCHEMBL1152916 0.84 CYP1A2 (0.32) CYP1A2MAPTCYP2C19KMT2AAKR1B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040023955-A1 Tricyclic-2-pyridone compounds useful as HIV reverse transcriptase inhibitors RODGERS JAMES D (US) 2004-02-05 US claimed
US-6596729-B2 Especially in combination with one or more HIV reverse transcriptase inhibitors, HIV protease inhibitors, fusion inhibitors, and/or CCR-5 BRISTOL-MYERS SQUIBB COMPANY 2003-07-22 US claimed
US-20020107261-A1 Tricyclic-2-pyridone compounds useful as HIV reverse transcriptase inhibitors DUPONT PHARMACEUTICALS COMPANY 2002-08-08 US claimed
US-20130289024-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF FILOVIRUS-MEDIATED DISEASES U.S. ARMY MEDICAL RESEARCH AND MATERIEL COMMAND 2013-10-31 US disclosed
US-6969721-B2 Tricyclic-2-pyridone compounds useful as HIV reverse transcriptase inhibitors BRISTOL-MYERS SQUIBB PHARMA (US) 2005-11-29 US disclosed
US-20040023955-A1 Tricyclic-2-pyridone compounds useful as HIV reverse transcriptase inhibitors RODGERS JAMES D (US) 2004-02-05 US disclosed
US-6596729-B2 Especially in combination with one or more HIV reverse transcriptase inhibitors, HIV protease inhibitors, fusion inhibitors, and/or CCR-5 BRISTOL-MYERS SQUIBB COMPANY 2003-07-22 US disclosed
US-20020107261-A1 Tricyclic-2-pyridone compounds useful as HIV reverse transcriptase inhibitors DUPONT PHARMACEUTICALS COMPANY 2002-08-08 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 (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-20130289024-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF FILOVIRUS-MEDIATED DISEASES FLNA, FLNB, PIGS HTR7 4258/4885CYP1A2 3895/4885MAPT 1583/4885
US-20040023955-A1 Tricyclic-2-pyridone compounds useful as HIV reverse transcriptase inhibitors TYMP, POLRMT, DPYD HTR7 1449/4885CYP1A2 403/4885MAPT 1600/4885
US-20020107261-A1 Tricyclic-2-pyridone compounds useful as HIV reverse transcriptase inhibitors TYMP, POLRMT, DPYD HTR7 1449/4885CYP1A2 403/4885MAPT 1600/4885

“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.