SCHEMBL10596239

SCHEMBL10596239

[O]Cc1ccccc1C(=O)OCc1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.67
TDP1 Q9NUW8 4/20 0.65
KMT2A Q03164 2/20 0.58
SLC6A2 P23975 1/20 0.58
SLC6A3 Q01959 1/20 0.58
L3MBTL1 Q9Y468 6/20 0.56
TSHR P16473 3/20 0.56
CYP3A4 P08684 2/20 0.56
MAPK1 P28482 2/20 0.56
POLB P06746 1/20 0.55
LMNA P02545 2/20 0.53
CASP3 P42574 1/20 0.51
RAB9A P51151 1/20 0.51
SENP8 Q96LD8 1/20 0.51
SENP7 Q9BQF6 1/20 0.51
SENP6 Q9GZR1 1/20 0.51
CYP2C9 P11712 2/20 0.50
CYP2C19 P33261 2/20 0.50
NPSR1 Q6W5P4 2/20 0.50
CYP1A2 P05177 1/20 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
SCHEMBL13469252 0.86 ALDH1A1 (0.67) ALDH1A1TDP1KMT2ASLC6A2SLC6A3
SCHEMBL5462907 0.86 ALDH1A1 (0.67) ALDH1A1TDP1KMT2ASLC6A2SLC6A3
SCHEMBL8839214 0.86 ALDH1A1 (0.67) ALDH1A1TDP1KMT2ASLC6A2SLC6A3
SCHEMBL2720454 0.86 ALDH1A1 (0.67) ALDH1A1TDP1KMT2ASLC6A2SLC6A3
SCHEMBL29388715 0.85 ALDH1A1 (0.89) ALDH1A1TDP1KMT2ASLC6A2SLC6A3
SCHEMBL50441 0.85 ALDH1A1 (0.89) ALDH1A1TDP1KMT2ASLC6A2SLC6A3
SCHEMBL8792301 0.85 ALDH1A1 (0.65) ALDH1A1TDP1KMT2ASLC6A2SLC6A3
SCHEMBL6343540 0.85 ALDH1A1 (0.65) ALDH1A1TDP1KMT2ASLC6A2SLC6A3
SCHEMBL7285341 0.85 ALDH1A1 (0.65) ALDH1A1TDP1KMT2ASLC6A2SLC6A3
SCHEMBL1445005 0.85 ALDH1A1 (0.65) ALDH1A1TDP1KMT2ASLC6A2SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0196026-B1 FUNCTIONAL DERIVATIVES OF PHOSPHORUS CONTAINING ACETIC ACIDS, PROCESS FOR THEIR PREPARATION AND HERBICIDAL AND PLANT GROWTH REGULATOR COMPOSITION CONTAINING THEM HOECHST AKTIENGESELLSCHAFT (DE) 1989-05-31 EP claimed
US-4776875-A Functional acetic acid derivatives containing phosphorus and herbicidal, growth-regulating agents containing them HOECHST AKTIENGESELLSCHAFT (DE) 1988-10-11 US claimed
EP-0196026-A1 Functional derivatives of phosphorus containing acetic acids, process for their preparation and herbicidal and plant growth regulator composition containing them HOECHST AKTIENGESELLSCHAFT (DE) 1986-10-01 EP claimed
EP-0196026-B1 FUNCTIONAL DERIVATIVES OF PHOSPHORUS CONTAINING ACETIC ACIDS, PROCESS FOR THEIR PREPARATION AND HERBICIDAL AND PLANT GROWTH REGULATOR COMPOSITION CONTAINING THEM HOECHST AKTIENGESELLSCHAFT (DE) 1989-05-31 EP disclosed
US-4776875-A Functional acetic acid derivatives containing phosphorus and herbicidal, growth-regulating agents containing them HOECHST AKTIENGESELLSCHAFT (DE) 1988-10-11 US disclosed
EP-0196026-A1 Functional derivatives of phosphorus containing acetic acids, process for their preparation and herbicidal and plant growth regulator composition containing them HOECHST AKTIENGESELLSCHAFT (DE) 1986-10-01 EP disclosed