SCHEMBL21712217

SCHEMBL21712217

COC(=O)c1cc2cccc(NC(=S)NC(=O)c3ccccc3)c2s1

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 8/20 0.60
▸ KMT2A Q03164 8/20 0.60
▸ MAPT P10636 7/20 0.60
▸ MEN1 O00255 6/20 0.60
▸ ALOX12 P18054 5/20 0.60
▸ KDM4E B2RXH2 5/20 0.60
▸ HPGD P15428 1/20 0.60
▸ NPC1 O15118 2/20 0.53
▸ RAB9A P51151 2/20 0.53
▸ EPHX1 P07099 2/20 0.52
▸ NPSR1 Q6W5P4 1/20 0.51
▸ TDP1 Q9NUW8 1/20 0.49
▸ MAPK1 P28482 1/20 0.49
▸ HTT P42858 1/20 0.49
▸ BLM P54132 1/20 0.49
▸ POLB P06746 1/20 0.47

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
SCHEMBL3255235 0.76 HPGD (0.56) ALDH1A1KMT2AMAPTMEN1KDM4E
SCHEMBL6118209 0.73 EPHX1 (0.78) ALDH1A1KMT2AMAPTMEN1ALOX12
SCHEMBL21712250 0.73 KDM4E (0.47) ALDH1A1KMT2AMAPTMEN1ALOX12
SCHEMBL14162005 0.73 MEN1 (0.74) ALDH1A1KMT2AMAPTMEN1ALOX12
SCHEMBL8612464 0.72 EPHX1 (0.77) ALDH1A1KMT2AMAPTMEN1ALOX12
SCHEMBL14096335 0.72 RAB9A (0.77) ALDH1A1KMT2AMAPTMEN1ALOX12
SCHEMBL3257419 0.72 KDR (0.55) ALDH1A1KMT2AMAPTMEN1KDM4E
SCHEMBL4496604 0.72 L3MBTL1 (0.76) ALDH1A1KMT2AMAPTMEN1ALOX12
SCHEMBL8613625 0.71 EPHX1 (0.76) ALDH1A1KMT2AMAPTMEN1ALOX12
SCHEMBL18340816 0.71 ALDH1A1 (0.63) ALDH1A1KMT2AMAPTMEN1ALOX12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020036812-A1 ACTIVATORS OF THE RETINOIC ACID INDUCIBLE GENE \"RIG-I\" PATHWAY AND METHODS OF USE THEREOF Kineta, Inc. (US) 2020-02-20 — — WO disclosed
WO-2020036812-A1 ACTIVATORS OF THE RETINOIC ACID INDUCIBLE GENE \"RIG-I\" PATHWAY AND METHODS OF USE THEREOF Kineta, Inc. (US) 2020-02-20 — — WO disclosed
WO-2020036574-A1 ACTIVATORS OF THE RETINOIC ACID INDUCIBLE GENE \"RIG-I' PATHWAY AND METHODS OF USE THEREOF Kineta, Inc. (US) 2020-02-20 — — WO disclosed
US-20200055871-A1 ACTIVATORS OF THE RETINOIC ACID INDUCIBLE GENE \"RIG-I\" PATHWAY AND METHODS OF USE THEREOF Kineta Immuno-Oncology LLC 2020-02-20 — — US disclosed
US-20200055871-A1 ACTIVATORS OF THE RETINOIC ACID INDUCIBLE GENE \"RIG-I\" PATHWAY AND METHODS OF USE THEREOF Kineta Immuno-Oncology LLC 2020-02-20 — — 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-20200055871-A1 ACTIVATORS OF THE RETINOIC ACID INDUCIBLE GENE \"RIG-I\" PATHWAY AND METHODS OF USE THEREOF RARB, RARG, RARA ALDH1A1 72/4885KMT2A 3906/4885MAPT 4826/4885

“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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