SCHEMBL16912677

SCHEMBL16912677

O=C(CBr)Nc1ccc(-c2c3nc(c(-c4ccccc4)c4ccc([nH]4)c(-c4ccccc4)c4nc(c(-c5ccccc5)c5ccc2[nH]5)C=C4)C=C3)cc1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ TOP1 P11387 3/20 0.54
▸ CYCS P99999 4/20 0.53
▸ ABCG2 Q9UNQ0 1/20 0.46
▸ ENPP2 Q13822 1/20 0.46
▸ ALDH1A1 P00352 2/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ MITF O75030 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ STAT3 P40763 1/20 0.42
▸ STAT1 P42224 1/20 0.42
▸ JAK3 P52333 1/20 0.42
▸ TERT O14746 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ KMT2A Q03164 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
SCHEMBL2125691 0.90 JAK3 (0.53) TOP1CYCSABCG2ALDH1A1NPC1
SCHEMBL16923748 0.88 ALDH1A1 (0.55) TOP1CYCSABCG2ENPP2ALDH1A1
SCHEMBL8572426 0.87 TOP1 (0.53) TOP1CYCSABCG2MEN1MAPT
SCHEMBL16920374 0.85 SMN1; SMN2 (0.54) TOP1CYCSABCG2ALDH1A1NPC1
SCHEMBL2403632 0.81 TOP1 (0.54) TOP1CYCSABCG2ENPP2ALDH1A1
SCHEMBL13609844 0.80 TOP1 (0.53) TOP1CYCSABCG2ENPP2ALDH1A1
SCHEMBL16923657 0.80 MEN1 (0.53) TOP1CYCSALDH1A1NPC1RAB9A
SCHEMBL31121523 0.78 TOP1 (0.62) TOP1CYCSENPP2STAT3STAT1
SCHEMBL31121522 0.78 TOP1 (0.62) TOP1CYCSENPP2STAT3STAT1
SCHEMBL8994447 0.78 TOP1 (0.60) TOP1CYCSABCG2ENPP2ALDH1A1

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
EP-3185901-B1 COMPOUND AND METHOD PCI BIOTECH AS (NO) 2023-10-04 — — EP disclosed
US-9901636-B2 Conjugate of a photosensitiser and chitosan and uses thereof PCI BIOTECH AS (NO) 2018-02-27 — — US disclosed
US-20150202293-A1 CONJUGATE OF A PHOTOSENSITISER AND CHITOSAN AND USES THEREOF PCI BIOTECH AS (NO) 2015-07-23 — — US disclosed
US-20150202293-A1 CONJUGATE OF A PHOTOSENSITISER AND CHITOSAN AND USES THEREOF PCI BIOTECH AS (NO) 2015-07-23 — — 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-20150202293-A1 CONJUGATE OF A PHOTOSENSITISER AND CHITOSAN AND USES THEREOF TLR3, CD47, TLR9 TOP1 2741/4885CYCS 3103/4885ABCG2 2446/4885

“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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