SCHEMBL4573277

SCHEMBL4573277

O=C(NCCN1CCCC1)Nc1cc[c]cc1

nearest known ligand 0.72

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.72
KMT2A Q03164 3/20 0.72
POLB P06746 2/20 0.72
CNR1 P21554 3/20 0.70
NPSR1 Q6W5P4 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.54
LMNA P02545 1/20 0.54
HTR3A P46098 2/20 0.54
MAPT P10636 1/20 0.53
EPHX2 P34913 1/20 0.53

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
SCHEMBL3761624 0.87 SMN1; SMN2 (0.72) MEN1KMT2APOLBCNR1NPSR1
SCHEMBL3757775 0.87 MEN1 (0.55) MEN1KMT2APOLBCNR1SMN1; SMN2
SCHEMBL10923255 0.85 KMT2A (0.97) MEN1KMT2APOLBCNR1NPSR1
SCHEMBL10921358 0.84 KMT2A (1.00) MEN1KMT2APOLBCNR1NPSR1
Bromide SCHEMBL10555741 0.84 KMT2A (0.94) MEN1KMT2APOLBCNR1NPSR1
SCHEMBL10922672 0.84 CNR1 (0.76) MEN1KMT2APOLBCNR1NPSR1
SCHEMBL10553825 0.84 KMT2A (1.00) MEN1KMT2APOLBCNR1NPSR1
SCHEMBL13102351 0.82 CNR1 (0.74) MEN1KMT2APOLBCNR1NPSR1
SCHEMBL10557515 0.82 MEN1 (0.76) MEN1KMT2APOLBCNR1SMN1; SMN2
SCHEMBL22834152 0.82 CNR1 (1.00) MEN1KMT2APOLBCNR1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8729089-B2 Pyrido(3,2-d)pyrimidines useful for treating viral infections GILEAD SCIENCES, INC. (US) 2014-05-20 US claimed
US-20080182870-A1 PYRIDO(3,2-d)PYRIMIDINES USEFUL FOR TREATING VIRAL INFECTIONS GILEAD SCIENCES, INC. (US) 2008-07-31 US claimed
WO-2008077651-A1 PYRIDO(3,2-D)PYRIMIDINES USEFUL FOR TREATING VIRAL INFECTIONS GILEAD SCIENCES, INC. (US) 2008-07-03 WO claimed
US-8729089-B2 Pyrido(3,2-d)pyrimidines useful for treating viral infections GILEAD SCIENCES, INC. (US) 2014-05-20 US disclosed
US-20080182870-A1 PYRIDO(3,2-d)PYRIMIDINES USEFUL FOR TREATING VIRAL INFECTIONS GILEAD SCIENCES, INC. (US) 2008-07-31 US disclosed
WO-2008077651-A1 PYRIDO(3,2-D)PYRIMIDINES USEFUL FOR TREATING VIRAL INFECTIONS GILEAD SCIENCES, INC. (US) 2008-07-03 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-20080182870-A1 PYRIDO(3,2-d)PYRIMIDINES USEFUL FOR TREATING VIRAL INFECTIONS PNPO, DPYD, PNP MEN1 2912/4885KMT2A 4285/4885POLB 141/4885

“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.