SCHEMBL8952902

SCHEMBL8952902

Cn1nnc2c(C(=O)O)c(C(=O)O)ccc21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR3 P49019 2/20 0.47
RAB9A P51151 2/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
HPGD P15428 4/20 0.35
MAPT P10636 2/20 0.35
POLB P06746 1/20 0.35
CCKBR P32239 1/20 0.35
KDM4E B2RXH2 2/20 0.35
LMNA P02545 1/20 0.35
TSHR P16473 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
KEAP1 Q14145 3/20 0.35
SLC9A1 P19634 1/20 0.34
NPC1 O15118 1/20 0.34
MAPK1 P28482 1/20 0.33
ALDH1A1 P00352 1/20 0.33
GRN P28799 1/20 0.33
SORT1 Q99523 1/20 0.33
CYP1A2 P05177 1/20 0.33

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
SCHEMBL30622603 0.78 HCAR3 (0.45) HCAR3RAB9AMEN1KMT2AHPGD
SCHEMBL2012449 0.78 HCAR3 (0.45) HCAR3RAB9AMEN1KMT2AHPGD
SCHEMBL8952972 0.72 GABRP (0.38) RAB9AMEN1KMT2AHPGDMAPT
SCHEMBL8953195 0.72 KDM4E (0.40) HCAR3KMT2AMAPTPOLBKDM4E
SCHEMBL15257926 0.70 HAAO (0.39) HCAR3RAB9AHPGDPOLBKDM4E
SCHEMBL20547502 0.69 HCAR3 (0.43) HCAR3RAB9AMEN1KMT2AHPGD
SCHEMBL17909988 0.68 DHODH (0.49) HCAR3
SCHEMBL23809189 0.67 HCAR3 (0.41) HCAR3RAB9AMEN1KMT2AHPGD
SCHEMBL22989 0.66 CYP1A2 (0.61) HPGDMAPTPOLBKDM4ETSHR
SCHEMBL1988762 0.66 CYP1A2 (0.61) HPGDMAPTPOLBKDM4ETSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118184679-A Photothermal agent and preparation method thereof, photothermal nanoparticle and preparation method thereof, insulating material and self-repairing method of insulating material 中国石油天然气股份有限公司 2024-06-14 CN claimed
CN-118184679-A Photothermal agent and preparation method thereof, photothermal nanoparticle and preparation method thereof, insulating material and self-repairing method of insulating material 中国石油天然气股份有限公司 2024-06-14 CN disclosed
US-5523279-A COMPOSITION FOR CONTROLLING MONOCOTYLEDENOUS AND DICOTYLEDENOUS PLANT SPECIES AMERICAN CYANAMID COMPANY (US) 1996-06-04 US disclosed
US-5516751-A NONPHYTOTOXIC; SUGAR BEETS, SOYBEANS AMERICAN CYANAMID COMPANY (US) 1996-05-14 US disclosed
US-5453415-A To control monocotyledons and dicotyledones; apply to foilage, soil, or water containing seeds; pre-and post-emergence AMERICAN CYANAMID COMPANY (US) 1995-09-26 US disclosed
US-5300479-A Pre-and postemergence herbicides AMERICAN CYANAMID COMPANY (US) 1994-04-05 US disclosed
US-5108485-A Controlling monocotyledonous and dicotyledonous plants AMERICAN CYANAMID COMPANY (US) 1992-04-28 US disclosed