SCHEMBL3605332

SCHEMBL3605332

COC(=O)c1ccc(/C=C(/C)[N+](=O)[O-])cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FBP1 P09467 2/20 0.57
ALDH1A1 P00352 2/20 0.55
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
JAK2 O60674 1/20 0.55
MITF O75030 1/20 0.55
LMNA P02545 1/20 0.55
CYP1A2 P05177 1/20 0.55
CYP3A4 P08684 1/20 0.55
MAPT P10636 1/20 0.55
CYP2C9 P11712 1/20 0.55
NTSR1 P30989 1/20 0.55
CYP2C19 P33261 1/20 0.55
EGFR P00533 4/20 0.51
ABL1 P00519 1/20 0.51
ABL2 P42684 1/20 0.51
POLB P06746 1/20 0.48
CA1 P00915 4/20 0.47
CA2 P00918 4/20 0.47
TDP1 Q9NUW8 1/20 0.46

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
SCHEMBL3605335 1.00 FBP1 (0.57) FBP1ALDH1A1MEN1KMT2AJAK2
SCHEMBL3605327 1.00 FBP1 (0.57) FBP1ALDH1A1MEN1KMT2AJAK2
SCHEMBL10657636 0.83 FBP1 (0.53) FBP1ALDH1A1MEN1KMT2AJAK2
SCHEMBL10657629 0.83 FBP1 (0.53) FBP1ALDH1A1MEN1KMT2AJAK2
SCHEMBL5947884 0.82 FBP1 (0.55) FBP1ALDH1A1MEN1KMT2ACYP1A2
SCHEMBL4485640 0.82 FBP1 (0.55) FBP1ALDH1A1MEN1KMT2ACYP1A2
SCHEMBL3926163 0.82 FBP1 (0.55) FBP1ALDH1A1MEN1KMT2ACYP1A2
SCHEMBL7139089 0.81 FBP1 (0.68) FBP1ALDH1A1MEN1KMT2AJAK2
SCHEMBL7139084 0.81 FBP1 (0.68) FBP1ALDH1A1MEN1KMT2AJAK2
SCHEMBL7139086 0.81 FBP1 (0.68) FBP1ALDH1A1MEN1KMT2AJAK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
US-20170275289-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2017-09-28 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
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-20100298340-A1 Thiazol-Guanidine Derivatives Useful As A (Beta)-Related Pathologies ASTRAZENECA AB (SE) 2010-11-25 US disclosed
US-7504403-B2 Substituted heterocyclic compounds and methods of use AMGEN INC. (US) 2009-03-17 US disclosed
US-7504403-B2 Substituted heterocyclic compounds and methods of use AMGEN INC. (US) 2009-03-17 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-20100298340-A1 Thiazol-Guanidine Derivatives Useful As A (Beta)-Related Pathologies GRN, MAPT, GUCY1B1 FBP1 4360/4885ALDH1A1 1302/4885MEN1 3257/4885
US-20170275289-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF HDAC10, HDAC6, HDAC1 FBP1 2329/4885ALDH1A1 2604/4885MEN1 2230/4885
US-10155764-B2 Therapeutic compounds and uses thereof HDAC10, HDAC6, HDAC1 FBP1 2329/4885ALDH1A1 2604/4885MEN1 2230/4885

“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.