SCHEMBL14952249

SCHEMBL14952249

N#CC1=C(N)Oc2c(ccc3ccccc23)C1c1ccccc1F

nearest known ligand 0.73

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MYB P10242 14/20 0.73
MAPT P10636 3/20 0.64
MEN1 O00255 2/20 0.64
LMNA P02545 2/20 0.64
KMT2A Q03164 2/20 0.64
NPSR1 Q6W5P4 2/20 0.64
KDM4E B2RXH2 2/20 0.64
ALDH1A1 P00352 1/20 0.64
GAA P10253 2/20 0.63
NPC1 O15118 1/20 0.59
RAB9A P51151 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.58

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
SCHEMBL14952248 0.88 MYB (0.71) MYBMAPTMEN1LMNAKMT2A
SCHEMBL14952246 0.85 MYB (0.67) MYBMAPTMEN1LMNAKMT2A
SCHEMBL5045714 0.84 MYB (1.00) MYBMAPTMEN1LMNAKMT2A
SCHEMBL8543474 0.84 MYB (0.63) MYBMAPTMEN1LMNAKMT2A
SCHEMBL31237908 0.83 MYB (0.83) MYBMAPTMEN1LMNAKMT2A
SCHEMBL8538269 0.82 MYB (0.76) MYBMAPTMEN1LMNAKMT2A
SCHEMBL14478940 0.82 MYB (0.73) MYB
SCHEMBL8538804 0.81 MYB (0.84) MYBMAPTMEN1LMNAKMT2A
SCHEMBL8542913 0.81 MYB (0.74) MYBMAPTMEN1LMNAKMT2A
SCHEMBL8542892 0.80 MYB (0.69) MYBMAPTMEN1LMNAKMT2A

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
US-20140275174-A1 TREATMENT OF OVARIAN CANCER WITH 2-AMINO-4H-NAPHTHO[1,2-b]PYRAN-3-CARBONITRILES MEMORIAL SLOAN-KETTERING CANCER CENTER (US) 2014-09-18 US disclosed
US-20140275174-A1 TREATMENT OF OVARIAN CANCER WITH 2-AMINO-4H-NAPHTHO[1,2-b]PYRAN-3-CARBONITRILES MEMORIAL SLOAN-KETTERING CANCER CENTER (US) 2014-09-18 US disclosed
WO-2013070998-A1 TREATMENT OF OVARIAN CANCER WITH 2-AMINO-4H-NAPHTHO[1,2-b]PYRAN-3-CARBONITRILES MEMORIAL SLOAN-KETTERING CANCER CENTER (US) 2013-05-16 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-20140275174-A1 TREATMENT OF OVARIAN CANCER WITH 2-AMINO-4H-NAPHTHO[1,2-b]PYRAN-3-CARBONITRILES CRBN, CCNY, CDY1; CDY1B MYB 4845/4885MAPT 4885/4885MEN1 1247/4885

“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.