SCHEMBL7246186

SCHEMBL7246186

Nc1ccc(-c2c3nc(c(-c4cnc5ccccc5c4)c4ccc([nH]4)c(-c4cnc5ccccc5c4)c4nc(c(-c5cnc6ccccc6c5)c5ccc2[nH]5)C=C4)C=C3)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TOP1 P11387 4/20 0.56
▸ PIM1 P11309 4/20 0.44
▸ BMPR1B O00238 1/20 0.44
▸ PIK3C2G O75747 1/20 0.44
▸ CDKL5 O76039 1/20 0.44
▸ TYK2 P29597 1/20 0.44
▸ CLK2 P49760 1/20 0.44
▸ DYRK1A Q13627 1/20 0.44
▸ STK32B Q9NY57 1/20 0.44
▸ PI4KB Q9UBF8 1/20 0.44
▸ IRAK3 Q9Y616 1/20 0.44
▸ CYCS P99999 3/20 0.42
▸ PIM3 Q86V86 3/20 0.42
▸ PIM2 Q9P1W9 3/20 0.42
▸ ENPP2 Q13822 1/20 0.41
▸ CA12 O43570 1/20 0.41
▸ CA1 P00915 1/20 0.41
▸ CA2 P00918 1/20 0.41
▸ CA9 Q16790 1/20 0.41
▸ TERT O14746 1/20 0.41

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
Quinoline SCHEMBL28173578 0.85 TOP1 (0.63) TOP1CYCSENPP2TERTSTAT3
Quinoline SCHEMBL28121893 0.82 TOP1 (0.60) TOP1CYCSENPP2TERTSTAT3
SCHEMBL28008849 0.81 TOP1 (0.72) TOP1CYCSENPP2TERTSTAT3
SCHEMBL3999312 0.81 TOP1 (0.72) TOP1CYCSENPP2TERTSTAT3
SCHEMBL27899186 0.81 TOP1 (0.72) TOP1CYCSENPP2TERTSTAT3
SCHEMBL29962487 0.81 TOP1 (0.72) TOP1CYCSENPP2TERTSTAT3
SCHEMBL28022267 0.81 TOP1 (0.72) TOP1CYCSENPP2TERTSTAT3
SCHEMBL30616040 0.81 TOP1 (0.72) TOP1CYCSENPP2TERTSTAT3
SCHEMBL3424111 0.81 TOP1 (0.81) TOP1CYCSENPP2TERTSTAT3
Hydrochloric Acid SCHEMBL8203834 0.81 CYP2A6 (0.59) TOP1PIM1BMPR1BPIK3C2GCDKL5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030105130-A1 Thiaporphyrin, selenaporphyrin, and carotenoid porphyrin compounds as c-myc and telomerase inhibitors NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2003-06-05 — — 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 (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-20030105130-A1 Thiaporphyrin, selenaporphyrin, and carotenoid porphyrin compounds as c-myc and telomerase inhibitors MYCBP, MYC, TERF2IP TOP1 132/4885PIM1 246/4885BMPR1B 2819/4885

“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.

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