SCHEMBL11517880

SCHEMBL11517880

Nc1cc(I)c(C(=O)O)c(I)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TPMT P51580 3/20 0.41
▸ KMT2A Q03164 8/20 0.40
▸ MEN1 O00255 6/20 0.40
▸ TDP1 Q9NUW8 4/20 0.40
▸ MAPT P10636 3/20 0.40
▸ THRB P10828 2/20 0.40
▸ RECQL P46063 2/20 0.40
▸ USP2 O75604 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ PKM P14618 1/20 0.40
▸ APEX1 P27695 1/20 0.40
▸ BLM P54132 1/20 0.40
▸ MCL1 Q07820 1/20 0.40
▸ KDM4E B2RXH2 8/20 0.39
▸ TSHR P16473 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ GFER P55789 1/20 0.37
▸ RXFP1 Q9HBX9 1/20 0.37
▸ ALDH1A1 P00352 7/20 0.35
▸ HSD17B10 Q99714 3/20 0.35

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
SCHEMBL2336086 0.79 TTR (0.46) TPMTKMT2AMEN1PKMKDM4E
SCHEMBL23600932 0.77 CYP3A4 (0.46) TPMTKMT2AMEN1TSHRMAPK1
Hydrochloric Acid SCHEMBL8425075 0.77 TTR (0.43) TPMTKMT2AMEN1TDP1MAPT
Hydrochloric Acid SCHEMBL11880989 0.76 THRB (0.33) KMT2AMEN1TDP1MAPTTHRB
SCHEMBL25604521 0.75 TPMT (0.48) TPMTKMT2AMEN1POLBKDM4E
SCHEMBL124763 0.75 TSHR (0.46) TPMTKMT2AMEN1TDP1MAPT
SCHEMBL27980012 0.75 TPMT (0.46) TPMTKMT2AMEN1TDP1MAPT
SCHEMBL31086644 0.75 TSHR (0.42) TPMTKMT2AMEN1TDP1MAPT
SCHEMBL29394151 0.75 TSHR (0.46) TPMTKMT2AMEN1TDP1MAPT
SCHEMBL377395 0.74 MAPK1 (0.53) TPMTKMT2AMEN1TDP1KDM4E

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-4688005-A1 POLYURETHANE-BASED RADIOPAQUE CROSSLINKED HYDROGELS WITH NON-ISOCYANATE PRECURSOR FOR MEDICAL APPLICATIONS Boston Scientific Scimed Inc. (US) 2026-02-11 — — EP disclosed
WO-2024206223-A1 POLYURETHANE-BASED RADIOPAQUE CROSSLINKED HYDROGELS WITH NON-ISOCYANATE PRECURSOR FOR MEDICAL APPLICATIONS BOSTON SCIENTIFIC SCIMED, INC. (US) 2024-10-03 — — WO disclosed
US-20240317944-A1 POLYURETHANE-BASED RADIOPAQUE CROSSLINKED HYDROGELS WITH NON-ISOCYANATE PRECURSOR FOR MEDICAL APPLICATIONS BOSTON SCIENTIFIC SCIMED, INC. (US) 2024-09-26 — — US disclosed
US-4172098-A REACTION OF A HALOAMINOBENZOIC ACID WITH AN ALCOHOL AND NITROSYLATING AGENT IN THE PRESCENCE OF AN ACID AND WATER BASF AKTIENGESELLSCHAFT (DE) 1979-10-23 — — US disclosed
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