SCHEMBL2746679

SCHEMBL2746679

CC(=Cc1ccc(O)cc1)[N+](=O)[O-]

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FBP1 P09467 8/20 0.69
ALDH1A1 P00352 3/20 0.66
EGFR P00533 2/20 0.66
LMNA P02545 2/20 0.66
MAPT P10636 2/20 0.66
MEN1 O00255 2/20 0.66
KMT2A Q03164 2/20 0.66
JAK2 O60674 1/20 0.66
MITF O75030 1/20 0.66
CYP1A2 P05177 1/20 0.66
CYP3A4 P08684 1/20 0.66
CYP2C9 P11712 1/20 0.66
NTSR1 P30989 1/20 0.66
CYP2C19 P33261 1/20 0.66
ABL1 P00519 1/20 0.66
ABL2 P42684 1/20 0.66
KDM4E B2RXH2 1/20 0.52
ESR1 P03372 3/20 0.48
ESR2 Q92731 3/20 0.48
NQO2 P16083 1/20 0.44

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
SCHEMBL2746676 1.00 FBP1 (0.69) FBP1ALDH1A1EGFRLMNAMAPT
SCHEMBL2746675 1.00 FBP1 (0.69) FBP1ALDH1A1EGFRLMNAMAPT
SCHEMBL27946453 0.84 FBP1 (0.69) FBP1ALDH1A1EGFRLMNAMAPT
SCHEMBL27957137 0.84 FBP1 (0.69) FBP1ALDH1A1EGFRLMNAMAPT
SCHEMBL10664676 0.84 FBP1 (0.69) FBP1ALDH1A1EGFRLMNAMAPT
SCHEMBL1245804 0.82 FBP1 (0.67) FBP1ALDH1A1EGFRLMNAMAPT
SCHEMBL6469686 0.82 FBP1 (0.67) FBP1ALDH1A1EGFRLMNAMAPT
SCHEMBL6469695 0.82 FBP1 (0.67) FBP1ALDH1A1EGFRLMNAMAPT
SCHEMBL107299 0.82 FBP1 (0.67) FBP1ALDH1A1EGFRLMNAMAPT
SCHEMBL15510679 0.82 FBP1 (0.67) FBP1ALDH1A1EGFRLMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1993001824-A1 COMBINATION THERAPY USING BIOFLAVONOID COMPOUNDS WITH ANTI-CANCER DRUGS BAYLOR COLLEGE OF MEDICINE (US) 1993-02-04 WO claimed
EP-3189049-B1 PHTHALAZINE DERIVATIVES OF FORMULA (I) AS PCAF AND GCN5 INHIBITORS FOR USE IN THE TREATMENT OF CANCER GENENTECH INC (US) 2024-03-20 EP disclosed
CN-107074824-B Phthalazine derivatives of formula (I) as PCAF and GCN5 inhibitors for the treatment of cancer 基因泰克公司 2021-01-08 CN disclosed
US-10155764-B2 Therapeutic compounds and uses thereof GENENTECH, INC (US) 2018-12-18 US disclosed
US-20170275289-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2017-09-28 US disclosed
EP-3189049-A1 PHTHALAZINE DERIVATIVES OF FORMULA (I) AS PCAF AND GCN5 INHIBITORS FOR USE IN THE TREATMENT OF CANCER Genentech, Inc. (US) 2017-07-12 EP disclosed
WO-2016036954-A1 PHTHALAZINE DERIVATIVES OF FORMULA (I) AS PCAF AND GCN5 INHIBITORS FOR USE IN THE TREATMENT OF CANCER GENENTECH, INC. (US) 2016-03-10 WO disclosed
US-8178679-B2 Derivatives of 4-(2-amino-1-hydroxyethyl)phenol as agonists of the β2 adrenergic receptors ALMIRALL, S.A. (ES) 2012-05-15 US disclosed
US-20100324000-A1 DERIVATIVES OF 4-(2-AMINO-1-HYDROXYETHYL)PHENOL AS AGONISTS OF THE BETA2 ADRENERGIC RECEPTORS ALMIRALL, S.A. (ES) 2010-12-23 US disclosed
EP-2212276-A1 DERIVATIVES OF 4-(2-AMINO-1-HYDROXYETHYL)PHENOL AS AGONISTS OF THE BETA2 ADRENERGIC RECEPTOR Almirall, S.A. (ES) 2010-08-04 EP disclosed
WO-2009068177-A1 DERIVATIVES OF 4-(2-AMINO-1 -HYDROXYETHYL)PHENOL AS AGONISTS OF THE β2 ADRENERGIC RECEPTOR ALMIRALL, S.A. (ES) 2009-06-04 WO disclosed
WO-1993001824-A1 COMBINATION THERAPY USING BIOFLAVONOID COMPOUNDS WITH ANTI-CANCER DRUGS BAYLOR COLLEGE OF MEDICINE (US) 1993-02-04 WO disclosed
EP-0023385-B1 ETHANAMINE DERIVATIVES, THEIR PREPARATION AND USE IN PHARMACEUTICAL COMPOSITIONS BEECHAM GROUP PLC (GB) 1982-12-15 EP disclosed
US-4338333-A ANTIOBESITY, HYPOGLYCEMIC BEECHAM GROUP LIMITED (GB) 1982-07-06 US disclosed
US-3985761-A ANTIBACTERIAL AND ANTHELMINTIC PROPERTIES SARABHAI RESEARCH CENTRE (IN) 1976-10-12 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-20100324000-A1 DERIVATIVES OF 4-(2-AMINO-1-HYDROXYETHYL)PHENOL AS AGONISTS OF THE BETA2 ADRENERGIC RECEPTORS ADRB2, ADRB1, ADRA2C FBP1 3388/4885ALDH1A1 497/4885EGFR 1250/4885
US-20170275289-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF HDAC10, HDAC6, HDAC1 FBP1 2329/4885ALDH1A1 2604/4885EGFR 4611/4885
US-10155764-B2 Therapeutic compounds and uses thereof HDAC10, HDAC6, HDAC1 FBP1 2329/4885ALDH1A1 2604/4885EGFR 4611/4885

“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.