Trichloroacetic Acid

Trichloroacetic Acid

SCHEMBL9636965

NC(=NC1CCCCC1)N(C1CCCCC1)C1CCCCC1.O=C(O)C(Cl)(Cl)Cl

nearest known ligand 0.37

Full drug profile on Sugi Atlas →

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.34
HSD11B1 P28845 2/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.31
TP53 P04637 1/20 0.31
TSHR P16473 1/20 0.31
PHGDH O43175 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
Trichloroacetic Acid SCHEMBL9636957 1.00 SIGMAR1 (0.34) SIGMAR1HSD11B1KDM4EALDH1A1TP53
Bicarbonate SCHEMBL9555184 0.89 SIGMAR1 (0.39) SIGMAR1HSD11B1KDM4ETSHRPHGDH
Bicarbonate SCHEMBL9555194 0.89 SIGMAR1 (0.39) SIGMAR1HSD11B1KDM4ETSHRPHGDH
SCHEMBL3295732 0.85 SIGMAR1 (0.44) SIGMAR1HSD11B1KDM4EALDH1A1PHGDH
SCHEMBL3295724 0.85 SIGMAR1 (0.44) SIGMAR1HSD11B1KDM4EALDH1A1PHGDH
SCHEMBL3911153 0.83 SIGMAR1 (0.41) SIGMAR1KDM4EPHGDH
SCHEMBL7758402 0.79 SIGMAR1 (0.37) SIGMAR1KDM4EPHGDH
SCHEMBL34985 0.75 SLC6A2 (0.43) SIGMAR1PHGDH
SCHEMBL35554 0.75 SLC6A2 (0.38) SIGMAR1KDM4EPHGDH
SCHEMBL8334194 0.69 SIGMAR1 (0.37) SIGMAR1KDM4EPHGDH

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-0237058-B1 LIGHT SENSITIVE MATERIAL CONTAINING SILVER HALIDE, REDUCING AGENT AND POLYMERIZABLE COMPOUND FUJI PHOTO FILM CO., LTD. (JP) 1992-06-17 EP disclosed
US-4897335-A Light-sensitive material containing silver halide, reducing agent polymerizable compound, and base arranged outside of microcapsules FUJI PHOTO FILM CO., LTD. (JP) 1990-01-30 US disclosed
US-4842977-A Light-sensitive material containing silver halide, reducing agent, polymerizable compound and a base or base precursor FUJI PHOTO FILM CO., LTD. (JP) 1989-06-27 US disclosed
EP-0237058-A2 Light sensitive material containing silver halide, reducing agent and polymerizable compound FUJI PHOTO FILM CO., LTD. (JP) 1987-09-16 EP disclosed