SCHEMBL7247277

SCHEMBL7247277

Nc1ccc(C2=C3C=CC(=N3)C(c3ccncc3)=C3C=CC(=N3)C(c3ccncc3)=C3C=CC(=N3)C(c3ccncc3)=C3C=CC2=N3)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 2/20 0.42
▸ CYP17A1 P05093 1/20 0.42
▸ CYP19A1 P11511 1/20 0.42
▸ CYP11B1 P15538 1/20 0.42
▸ CYP11B2 P19099 1/20 0.42
▸ ALDH1A1 P00352 4/20 0.41
▸ LMNA P02545 3/20 0.41
▸ MAPT P10636 3/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ CYP2D6 P10635 1/20 0.41
▸ CHRM1 P11229 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ KCNA1 Q09470 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ TOP1 P11387 1/20 0.40
▸ RAD52 P43351 1/20 0.37
▸ PRKCZ Q05513 1/20 0.35
▸ TP53 P04637 1/20 0.34

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
SCHEMBL3424113 0.91 ALDH1A1 (0.42) CYP3A4CYP17A1CYP19A1CYP11B1CYP11B2
SCHEMBL26095376 0.89 ALDH1A1 (0.40) CYP3A4CYP17A1CYP19A1CYP11B1CYP11B2
SCHEMBL26096051 0.89 ALDH1A1 (0.40) CYP3A4CYP17A1CYP19A1CYP11B1CYP11B2
SCHEMBL245938 0.89 MAPT (0.43) CYP3A4ALDH1A1LMNAMAPTCYP2D6
SCHEMBL28121369 0.84 CYP3A4 (0.50) CYP3A4ALDH1A1LMNAMAPTMEN1
SCHEMBL3999316 0.84 CYP3A4 (0.50) CYP3A4ALDH1A1LMNAMAPTMEN1
SCHEMBL28121300 0.84 CYP3A4 (0.50) CYP3A4ALDH1A1LMNAMAPTMEN1
SCHEMBL7240131 0.82 AXL (0.42) CYP3A4ALDH1A1LMNAMAPTMEN1
SCHEMBL9582303 0.82 RPS6KA3 (0.43) CYP3A4CYP17A1CYP19A1CYP11B1CYP11B2
SCHEMBL6493307 0.82 NPC1 (0.40) ALDH1A1LMNAMAPTMEN1MAPK1

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-20030203888-A1 Chromophores WELLCOME TRUST LIMITED, THE (GB) 2003-10-30 — — US disclosed
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
EP-1294726-A2 IMPROVEMENTS IN AND RELATING TO CHROMOPHORES Catalyst Biomedica Ltd (GB) 2003-03-26 — — EP disclosed
WO-2002000662-A1 IMPROVEMENTS IN AND RELATING TO CHROMOPHORES CATALYST BIOMEDICA LIMITED (GB) 2002-01-03 — — 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 (2 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-20030203888-A1 Chromophores HCCS, PPOX, HMBS CYP3A4 1750/4885CYP17A1 3519/4885CYP19A1 2552/4885
US-20030105130-A1 Thiaporphyrin, selenaporphyrin, and carotenoid porphyrin compounds as c-myc and telomerase inhibitors MYCBP, MYC, TERF2IP CYP3A4 2410/4885CYP17A1 4120/4885CYP19A1 4069/4885

“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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