SCHEMBL7047327

SCHEMBL7047327

ON(Cc1ccc(Cl)cc1)Cc1ccc(Cl)cc1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.48
HTT P42858 1/20 0.48
RAB9A P51151 1/20 0.48
IDO1 P14902 3/20 0.46
PYCR1 P32322 1/20 0.45
TAAR1 Q96RJ0 1/20 0.42
LMNA P02545 1/20 0.42
CYP2A6 P11509 1/20 0.42
BCL2A1 Q16548 1/20 0.42
CNR2 P34972 1/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
SLC6A4 P31645 1/20 0.41
AGXT P21549 1/20 0.41
AOC3 Q16853 1/20 0.40

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
Hydrochloric Acid SCHEMBL5509033 0.97 ALDH1A1 (0.47) ALDH1A1HTTRAB9AIDO1PYCR1
SCHEMBL10941283 0.77 SLC6A2 (0.50) ALDH1A1IDO1PYCR1CNR2L3MBTL1
SCHEMBL10979593 0.76 ESR1 (0.54) ALDH1A1RAB9AIDO1TAAR1LMNA
SCHEMBL8781904 0.76 TSHR (0.46)
SCHEMBL10748300 0.76 CYP1A2 (0.53) ALDH1A1RAB9ATAAR1LMNACNR2
SCHEMBL9681275 0.75 ALDH1A1 (0.46) ALDH1A1HTTRAB9AIDO1PYCR1
SCHEMBL197287 0.74 HRH3 (0.64) ALDH1A1HTTRAB9AIDO1PYCR1
SCHEMBL7048734 0.74 LPL (0.46) ALDH1A1IDO1TAAR1CYP2A6
SCHEMBL18532755 0.74 PYCR1 (0.67) ALDH1A1HTTRAB9AIDO1PYCR1
SCHEMBL4967718 0.74 CYP2C19 (0.50) ALDH1A1IDO1PYCR1TAAR1CYP2A6

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-0941866-B1 Thermally imageable element having improved room light stability DU PONT (US) 2003-04-16 EP claimed
EP-0941866-A1 Non-photosensitive, thermally imageable element having improved room light stability E. I. du Pont de Nemours and Company (US) 1999-09-15 EP claimed
EP-0941866-B1 Thermally imageable element having improved room light stability DU PONT (US) 2003-04-16 EP disclosed
US-6251571-B1 MIXTURE OF OXIDIZER, DYE AND HYDROXYLAMINE E. I. DU PONT DE NEMOURS AND COMPANY 2001-06-26 US disclosed
EP-0941866-A1 Non-photosensitive, thermally imageable element having improved room light stability E. I. du Pont de Nemours and Company (US) 1999-09-15 EP disclosed
EP-0140378-A2 Discoloration-resistant spandex fiber E.I. DU PONT DE NEMOURS AND COMPANY (US) 1985-05-08 EP disclosed