SCHEMBL30442877

SCHEMBL30442877

COc1cc(C(=O)Nc2cc(-c3nc4ccccc4[nH]3)ccc2C)ccc1OCc1ccc(Cl)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 12/20 0.63
▸ SMN1; SMN2 Q16637 4/20 0.63
▸ TP53 P04637 4/20 0.63
▸ ALDH1A1 P00352 4/20 0.61
▸ MEN1 O00255 3/20 0.61
▸ KMT2A Q03164 3/20 0.61
▸ NPSR1 Q6W5P4 2/20 0.61
▸ KDM4E B2RXH2 2/20 0.61
▸ LMNA P02545 1/20 0.61
▸ MAPK14 Q16539 1/20 0.60
▸ SMO Q99835 1/20 0.60
▸ THRB P10828 3/20 0.60
▸ AMY1A P0DUB6 1/20 0.58
▸ NPC1 O15118 1/20 0.56
▸ CYP1A2 P05177 1/20 0.56
▸ CYP3A4 P08684 1/20 0.56
▸ CYP2D6 P10635 1/20 0.56
▸ CYP2C19 P33261 1/20 0.56
▸ HPGD P15428 3/20 0.54
▸ HTT P42858 1/20 0.54

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
SCHEMBL25232982 1.00 MAPT (0.63) MAPTSMN1; SMN2TP53ALDH1A1MEN1
SCHEMBL25200815 0.87 COMT (0.63) MAPTSMN1; SMN2TP53ALDH1A1MEN1
SCHEMBL30443231 0.87 COMT (0.63) MAPTSMN1; SMN2TP53ALDH1A1MEN1
SCHEMBL14615274 0.85 MAPT (0.80) MAPTSMN1; SMN2TP53ALDH1A1MEN1
SCHEMBL12848892 0.83 PDE4A (0.57) MAPTSMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL25656244 0.82 COMT (0.64) MAPTSMN1; SMN2TP53ALDH1A1MEN1
SCHEMBL14615276 0.81 MAPT (0.76) MAPTSMN1; SMN2TP53ALDH1A1MEN1
SCHEMBL25211422 0.81 MAPK14 (0.79) MAPTSMN1; SMN2TP53ALDH1A1MEN1
SCHEMBL30445799 0.81 MAPK14 (0.79) MAPTSMN1; SMN2TP53ALDH1A1MEN1
SCHEMBL25208344 0.81 MAPT (0.62) MAPTSMN1; SMN2TP53ALDH1A1MEN1

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-4153172-B1 COMPOUNDS FOR USE IN THE REACTIVATION OF HIV IN LATENT HIV-INFECTED CELLS CENTRE NAT RECH SCIENT (FR) 2024-11-27 — — EP claimed
EP-4153172-A1 COMPOUNDS FOR USE IN THE REACTIVATION OF HIV IN LATENT HIV-INFECTED CELLS Centre National de la Recherche Scientifique (FR) 2023-03-29 — — EP claimed
US-20230172913-A1 COMPOUNDS FOR USE IN THE REACTIVATION OF HIV IN LATENT HIV-INFECTED CELLS CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2023-06-08 — — US disclosed
EP-4153172-A1 COMPOUNDS FOR USE IN THE REACTIVATION OF HIV IN LATENT HIV-INFECTED CELLS Centre National de la Recherche Scientifique (FR) 2023-03-29 — — EP 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-20230172913-A1 COMPOUNDS FOR USE IN THE REACTIVATION OF HIV IN LATENT HIV-INFECTED CELLS TARBP1, NFATC1, TARDBP MAPT 781/4885SMN1; SMN2 4842/4885TP53 821/4885

“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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