SCHEMBL11950554

SCHEMBL11950554

O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1sc2cc(Cl)ccc2c1Cl

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR3 O15455 1/20 0.80
NPSR1 Q6W5P4 3/20 0.53
HPGD P15428 3/20 0.53
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
CYP1A2 P05177 2/20 0.53
CYP3A4 P08684 2/20 0.53
CYP2C9 P11712 2/20 0.53
CYP2C19 P33261 2/20 0.53
PKM P14618 1/20 0.53
RXFP1 Q9HBX9 2/20 0.53
BCKDK O14874 1/20 0.53
MCL1 Q07820 1/20 0.53
PYGL P06737 1/20 0.53
SCN3A Q9NY46 1/20 0.52
NPC1 O15118 4/20 0.51
RAB9A P51151 4/20 0.51
MAPT P10636 4/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
ALDH1A1 P00352 2/20 0.50

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
SCHEMBL11498990 1.00 TLR3 (0.80) TLR3NPSR1HPGDMEN1KMT2A
SCHEMBL11498991 1.00 TLR3 (0.80) TLR3NPSR1HPGDMEN1KMT2A
SCHEMBL11498254 0.89 TLR3 (0.77) TLR3NPSR1HPGDMEN1KMT2A
SCHEMBL11951242 0.89 TLR3 (1.00) TLR3NPSR1HPGDRXFP1BCKDK
SCHEMBL11951244 0.89 TLR3 (1.00) TLR3NPSR1HPGDRXFP1BCKDK
SCHEMBL11301956 0.89 TLR3 (1.00) TLR3NPSR1HPGDRXFP1BCKDK
SCHEMBL11498253 0.89 TLR3 (0.77) TLR3NPSR1HPGDMEN1KMT2A
SCHEMBL11951240 0.89 TLR3 (0.77) TLR3NPSR1HPGDMEN1KMT2A
SCHEMBL17988516 0.89 TLR3 (0.77) TLR3NPSR1HPGDMEN1KMT2A
SCHEMBL17988518 0.89 TLR3 (0.77) TLR3NPSR1HPGDMEN1KMT2A

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-2025030019-A1 TARGETING TLR3 FOR TREATMENT OF HEMATOPOIETIC STEM CELL PROLIFERATION-ASSOCIATED DISEASES OR DISORDERS THE CHILDREN'S MEDICAL CENTER CORPORATION (US) 2025-02-06 WO disclosed
US-9409880-B2 Modulators of TLR3/dsRNA complex and uses thereof THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE (US) 2016-08-09 US disclosed
US-9409880-B2 Modulators of TLR3/dsRNA complex and uses thereof THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE (US) 2016-08-09 US disclosed
US-9409880-B2 Modulators of TLR3/dsRNA complex and uses thereof THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE (US) 2016-08-09 US disclosed
WO-2012099785-A2 MODULATORS OF TLR3/DSRNA COMPLEX AND USES THEREOF THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE (US) 2012-07-26 WO disclosed