SCHEMBL7017626

SCHEMBL7017626

Cc1ccc(C(=O)C=Cc2ccc(C)cc2N)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.57
ALDH1A1 P00352 6/20 0.56
HPGD P15428 4/20 0.56
HTT P42858 3/20 0.56
ATM Q13315 3/20 0.56
NPSR1 Q6W5P4 3/20 0.56
PKM P14618 3/20 0.56
LMNA P02545 3/20 0.56
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
NLRP1 Q9C000 1/20 0.56
NTSR1 P30989 1/20 0.56
TDP1 Q9NUW8 1/20 0.56
CYP1B1 Q16678 2/20 0.56
CYP1A1 P04798 1/20 0.56
RAB9A P51151 3/20 0.51
MAOA P21397 3/20 0.51
MAOB P27338 3/20 0.51
POLB P06746 1/20 0.51

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
SCHEMBL1501197 0.84 CYP1B1 (0.61) MAPTALDH1A1HPGDHTTATM
SCHEMBL19193879 0.83 CYP1B1 (0.76) MAPTALDH1A1HPGDHTTATM
SCHEMBL28008787 0.81 PELI1 (0.43) MAPTALDH1A1HTTLMNAMEN1
SCHEMBL14007608 0.81 PELI1 (0.43) MAPTALDH1A1HTTLMNAMEN1
SCHEMBL3009460 0.81 CYP3A4 (0.49) MAPTALDH1A1HPGDHTTNPSR1
SCHEMBL3009452 0.81 CYP3A4 (0.49) MAPTALDH1A1HPGDHTTNPSR1
SCHEMBL6171189 0.77 ALDH1A1 (0.50) MAPTALDH1A1HPGDHTTMEN1
SCHEMBL6171196 0.77 ALDH1A1 (0.50) MAPTALDH1A1HPGDHTTMEN1
SCHEMBL21985898 0.76 TDP1 (0.56) MAPTALDH1A1SMN1; SMN2TDP1RAB9A
SCHEMBL15807295 0.76 MAPT (0.75) MAPTALDH1A1HPGDHTTATM

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
US-20030065039-A1 Biologically active 1,3-bis-aromatic-prop-2-en-1-ones, 1,3-bis-aromatic-propan-1-ones, and 1,3-bis-aromatic-prop-2-yn-1-ones STATENS SERUM INSTITUTE (DK) 2003-04-03 US disclosed
EP-0672953-B1 Photosensitive recording material, photosensitive recording medium, and process for producing hologram using this photosensitive recording medium TOPPAN PRINTING CO LTD (JP) 2003-01-15 EP disclosed
EP-0996432-A2 BIOLOGICALLY ACTIVE 1,3-BIS-AROMATIC-PROP-2-EN-1-ONES, 1,3-BIS-AROMATIC-PROPAN-1-ONES, AND 1,3-BIS-AROMATIC-PROP-2-YN-1-ONES STATENS SERUMINSTITUT (DK) 2000-05-03 EP disclosed
WO-1999000114-A2 BIOLOGICALLY ACTIVE 1,3-BIS-AROMATIC-PROP-2-EN-1-ONES, 1,3-BIS-AROMATIC-PROPAN-1-ONES, AND 1,3-BIS-AROMATIC-PROP-2-YN-1-ONES STATENS SERUM INSTITUT (DK) 1999-01-07 WO disclosed
US-5698345-A CATIONIC POLYMERIZATION OF THERMOSETTING EPOXY OLIGOMER TOPPAN PRINTING CO., LTD. (JP) 1997-12-16 US disclosed
EP-0672953-A2 Photosensitive recording material, photosensitive recording medium, and process for producing hologram using this photosensitive recording medium Toppan Printing Co., Ltd. (JP) 1995-09-20 EP disclosed
US-4636459-A PHOTOINITIATOR AND UNSATURATED MONOMER; PRINTING PLATES FUJI PHOTO FILM CO., LTD. (JP) 1987-01-13 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030065039-A1 Biologically active 1,3-bis-aromatic-prop-2-en-1-ones, 1,3-bis-aromatic-propan-1-ones, and 1,3-bis-aromatic-prop-2-yn-1-ones AKR1C3, AKR1C1, AKR1A1 MAPT 3817/4885ALDH1A1 88/4885HPGD 271/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.