SCHEMBL4573126

SCHEMBL4573126

O=c1[nH]nc(Cc2ccnc(Br)c2)c2ccccc12

nearest known ligand 0.62

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 10/20 0.62
AR P10275 5/20 0.62
TSHR P16473 2/20 0.57
LMNA P02545 1/20 0.57
CYP3A4 P08684 1/20 0.56
CYP2C9 P11712 1/20 0.56
CYP2C19 P33261 1/20 0.56

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
SCHEMBL6610436 0.84 PARP1 (0.62) PARP1ARTSHRLMNACYP3A4
SCHEMBL26907192 0.83 TSHR (0.66) PARP1ARTSHRLMNACYP3A4
SCHEMBL4573019 0.81 PARP1 (0.70) PARP1ARTSHRLMNACYP3A4
SCHEMBL29655200 0.81 PARP1 (0.70) PARP1ARTSHRLMNACYP3A4
SCHEMBL26907276 0.81 PARP1 (0.58) PARP1ARTSHRLMNACYP3A4
SCHEMBL76707 0.81 PARP1 (0.62) PARP1ARTSHRLMNACYP3A4
SCHEMBL8270690 0.81 PARP1 (0.58) PARP1ARTSHRLMNACYP3A4
SCHEMBL905630 0.80 AR (0.79) PARP1ARTSHRLMNACYP3A4
SCHEMBL8154178 0.79 AR (0.77) PARP1ARTSHRLMNACYP3A4
SCHEMBL19748563 0.78 ENPP1 (0.64) PARP1ARTSHRLMNACYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080280910-A1 PHTHALAZINONE DERIVATIVES KUDOS PHARMACEUTICALS LIMITED (GB) 2008-11-13 US disclosed
US-20080280910-A1 PHTHALAZINONE DERIVATIVES KUDOS PHARMACEUTICALS LIMITED (GB) 2008-11-13 US disclosed
US-20080280910-A1 PHTHALAZINONE DERIVATIVES KUDOS PHARMACEUTICALS LIMITED (GB) 2008-11-13 US disclosed
WO-2008114023-A2 PHTHALAZINONE DERIVATIVES KUDOS PHARMACEUTICALS LIMITED (GB) 2008-09-25 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-20080280910-A1 PHTHALAZINONE DERIVATIVES H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, SDHA, NCOA4 PARP1 3512/4885AR 392/4885TSHR 3275/4885

“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.