SCHEMBL20601972

SCHEMBL20601972

O=C(CC/C(=N/O)OC(=O)C(CCSSc1ccccn1)S(=O)(=O)O)OC(=O)C(CCSSc1ccccn1)S(=O)(=O)O

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 13/20 0.36
HDAC2 Q92769 13/20 0.36
ALDH1A1 P00352 2/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
EHMT2 Q96KQ7 1/20 0.30
EHMT1 Q9H9B1 1/20 0.30
APOBEC3G Q9HC16 1/20 0.30

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
SCHEMBL574826 0.86 HDAC1 (0.37) HDAC1HDAC2ALDH1A1LMNAMAPT
SCHEMBL551390 0.80 ALDH1A1 (0.44) HDAC1HDAC2ALDH1A1LMNAMAPT
SCHEMBL17283454 0.79 HDAC1 (0.43) HDAC1HDAC2ALDH1A1LMNASMN1; SMN2
SCHEMBL29459657 0.77 ALDH1A1 (0.43) HDAC1HDAC2ALDH1A1MAPTKMT2A
SCHEMBL1120092 0.77 ALDH1A1 (0.43) HDAC1HDAC2ALDH1A1MAPTKMT2A
SCHEMBL18052248 0.76 EHMT2 (0.38) HDAC1HDAC2ALDH1A1MAPTKMT2A
SCHEMBL17758942 0.76 ALDH1A1 (0.39) HDAC1HDAC2ALDH1A1LMNAMAPT
SCHEMBL11927655 0.76 EHMT2 (0.40) HDAC1HDAC2ALDH1A1LMNAMAPT
SCHEMBL18726574 0.73 HDAC1 (0.37) HDAC1HDAC2ALDH1A1LMNAMAPT
SCHEMBL574827 0.73 HDAC1 (0.37) HDAC1HDAC2ALDH1A1LMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4378958-A2 HIGH-AFFINITY ANTI-MERTK ANTIBODIES AND USES THEREOF Inspirna, Inc. (US) 2024-06-05 EP disclosed
EP-3930847-B1 HIGH-AFFINITY ANTI-MERTK ANTIBODIES AND USES THEREOF INSPIRNA INC (US) 2024-02-14 EP disclosed
US-20230146646-A1 ANTI-MERTK AGONISTIC ANTIBODIES AND USES THEREOF THE ROCKEFELLER UNIVERSITY (US) 2023-05-11 US disclosed
US-11613588-B2 Anti-mertk agonistic antibodies and uses thereof THE ROCKEFELLER UNIVERSITY (US) 2023-03-28 US disclosed
US-20220220222-A1 HIGH-AFFINITY ANTI-MERTK ANTIBODIES AND USES THEREOF INSPIRNA, INC. (US) 2022-07-14 US disclosed
US-11242407-B2 High-affinity anti-MERTK antibodies and uses thereof INSPIRNA, INC. (US) 2022-02-08 US disclosed
EP-3930847-A1 HIGH-AFFINITY ANTI-MERTK ANTIBODIES AND USES THEREOF Inspirna, Inc. (US) 2022-01-05 EP disclosed
US-20200291135-A1 HIGH-AFFINITY ANTI-MERTK ANTIBODIES AND USES THEREOF RGENIX, INC. (US) 2020-09-17 US disclosed
US-20200255543-A1 ANTI-MERTK AGONISTIC ANTIBODIES AND USES THEREOF THE ROCKEFELLER UNIVERSITY (US) 2020-08-13 US disclosed
EP-3645041-A1 ANTI-MERTK AGONISTIC ANTIBODY-DRUG CONJUGATES AND USES THEREOF The Rockefeller University (US) 2020-05-06 EP disclosed
WO-2019005756-A1 ANTI-MERTK AGONISTIC ANTIBODY-DRUG CONJUGATES AND USES THEREOF THE ROCKEFELLER UNIVERSITY (US) 2019-01-03 WO disclosed