SCHEMBL16923748

SCHEMBL16923748

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

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.55
▸ MEN1 O00255 2/20 0.55
▸ KMT2A Q03164 2/20 0.55
▸ KDM4E B2RXH2 2/20 0.55
▸ MAPT P10636 2/20 0.55
▸ HPGD P15428 2/20 0.55
▸ TOP1 P11387 3/20 0.54
▸ CYCS P99999 4/20 0.53
▸ RAB9A P51151 2/20 0.53
▸ NPC1 O15118 1/20 0.53
▸ PDE10A Q9Y233 1/20 0.52
▸ ABCG2 Q9UNQ0 1/20 0.49
▸ GAA P10253 1/20 0.49
▸ ENPP2 Q13822 1/20 0.46
▸ GHSR Q92847 1/20 0.46
▸ TERT O14746 1/20 0.45

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
SCHEMBL16912677 0.88 TOP1 (0.54) ALDH1A1MEN1KMT2AKDM4EMAPT
SCHEMBL16920374 0.87 SMN1; SMN2 (0.54) ALDH1A1KDM4EHPGDTOP1CYCS
SCHEMBL8572426 0.87 TOP1 (0.53) MEN1KMT2AMAPTTOP1CYCS
SCHEMBL13609844 0.82 TOP1 (0.53) ALDH1A1MEN1KMT2AKDM4EMAPT
SCHEMBL16923657 0.82 MEN1 (0.53) ALDH1A1MEN1KMT2AKDM4EHPGD
SCHEMBL9018604 0.81 TOP1 (0.52) ALDH1A1TOP1CYCSABCG2ENPP2
SCHEMBL2403632 0.81 TOP1 (0.54) ALDH1A1KDM4EMAPTTOP1CYCS
SCHEMBL8994447 0.80 TOP1 (0.60) ALDH1A1MEN1KMT2AKDM4EMAPT
Acetic Acid SCHEMBL9639956 0.80 TOP1 (0.67) TOP1CYCSABCG2ENPP2TERT
SCHEMBL16920366 0.79 MEN1 (0.53) ALDH1A1MEN1KMT2AKDM4EHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

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 ALDH1A1 3397/4885MEN1 974/4885KMT2A 3280/4885

“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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