SCHEMBL8948064

SCHEMBL8948064

Cc1ccccc1C(=O)N(C(N)=O)C(=O)c1ccccc1C

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.50
TSHR P16473 1/20 0.47
MAPK1 P28482 1/20 0.47
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
MYC P01106 1/20 0.43
HPGD P15428 1/20 0.43
POLB P06746 1/20 0.42
ELANE P08246 1/20 0.42
TYK2 P29597 1/20 0.42
ERCC5 P28715 1/20 0.42
FEN1 P39748 1/20 0.42
ALDH1A1 P00352 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
TRPM8 Q7Z2W7 1/20 0.41

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
SCHEMBL8436163 0.85 KMT2A (0.47) KMT2ATSHRMAPK1NPC1RAB9A
SCHEMBL6869180 0.85 KMT2A (0.47) KMT2ATSHRMAPK1NPC1RAB9A
Boric Acid SCHEMBL8170320 0.80 KMT2A (0.44) KMT2ATSHRMAPK1NPC1RAB9A
SCHEMBL6832097 0.78 KMT2A (0.56) KMT2ATSHRMAPK1NPC1RAB9A
SCHEMBL11216342 0.77 KMT2A (0.59) KMT2ATSHRMAPK1MYCHPGD
Hydrochloric Acid SCHEMBL3870754 0.77 SIRT3 (0.53) TSHRNPC1RAB9AMYCHPGD
SCHEMBL354228 0.77 KMT2A (0.59) KMT2ATSHRMAPK1NPC1HPGD
SCHEMBL30037151 0.77 KMT2A (0.59) KMT2ATSHRMAPK1NPC1HPGD
SCHEMBL1558192 0.76 ALDH1A1 (0.56) TSHRNPC1RAB9AMYCHPGD
SCHEMBL6099 0.76 ALDH1A1 (0.56) TSHRNPC1RAB9AMYCHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4238640-A1 MICROCAPSULE HAVING CORE-SHELL STRUCTURE, AND PRODUCTION METHOD FOR SAME Insilico Co., Ltd. (KR) 2023-09-06 EP disclosed
US-20230183563-A1 MICROCAPSULE HAVING CORE-SHELL STRUCTURE, AND PRODUCTION METHOD FOR SAME INSILICO CO. LTD. (KR) 2023-06-15 US disclosed
WO-2022092355-A1 MICROCAPSULE HAVING CORE-SHELL STRUCTURE, AND PRODUCTION METHOD FOR SAME 주식회사 인실리코 2022-05-05 WO disclosed
US-10591838-B2 Electrostatic ink compositions HP INDIGO B.V. (NL) 2020-03-17 US disclosed
US-20190016907-A1 ELECTROSTATIC INK COMPOSITIONS HP INDIGO B.V. (NL) 2019-01-17 US disclosed
EP-3374448-A1 ELECTROSTATIC INK COMPOSITIONS HP INDIGO B.V. (NL) 2018-09-19 EP disclosed
WO-2017157473-A1 ELECTROSTATIC INK COMPOSITIONS HP INDIGO B.V. (NL) 2017-09-21 WO disclosed
US-5500040-A Ultraviolet-curable thermochromic ink composition SAKURA COLOR PRODUCTS CORPORATION (JP) 1996-03-19 US disclosed