SCHEMBL7889494

SCHEMBL7889494

O=C(c1ccccc1)c1ccc(CCc2ccc(C(=O)c3ccccc3)cc2)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.67
SRD5A2 P31213 5/20 0.62
HDAC1 Q13547 1/20 0.59
ATM Q13315 2/20 0.56
L3MBTL1 Q9Y468 2/20 0.56
TDP1 Q9NUW8 1/20 0.56
FFAR1 O14842 1/20 0.56
MEN1 O00255 3/20 0.54
KMT2A Q03164 3/20 0.54
RAB9A P51151 2/20 0.54
LMNA P02545 1/20 0.54
MAPT P10636 1/20 0.54
MAPK13 O15264 1/20 0.54
MAPK12 P53778 1/20 0.54
MAPK11 Q15759 1/20 0.54
MAPK14 Q16539 1/20 0.54
HPGD P15428 2/20 0.52
NPC1 O15118 1/20 0.52
CES2 O00748 1/20 0.52
CES1 P23141 1/20 0.52

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
SCHEMBL7898126 0.98 ALDH1A1 (0.64) ALDH1A1SRD5A2HDAC1ATML3MBTL1
SCHEMBL27628329 0.90 SRD5A2 (0.59) ALDH1A1SRD5A2HDAC1L3MBTL1MEN1
SCHEMBL8026026 0.89 TDP1 (0.60) ALDH1A1SRD5A2HDAC1ATML3MBTL1
SCHEMBL28251464 0.89 HDAC1 (0.62) ALDH1A1SRD5A2HDAC1TDP1MEN1
SCHEMBL8041554 0.87 HTR2A (0.58) ALDH1A1SRD5A2HDAC1ATML3MBTL1
SCHEMBL4605419 0.87 L3MBTL1 (0.58) ALDH1A1SRD5A2L3MBTL1KMT2ARAB9A
Benzophenone SCHEMBL28417175 0.87 L3MBTL1 (0.58) ALDH1A1SRD5A2L3MBTL1KMT2ARAB9A
SCHEMBL4138253 0.87 SRD5A2 (0.75) ALDH1A1SRD5A2HDAC1FFAR1SMN1; SMN2
SCHEMBL5433433 0.87 TDP1 (0.58) ALDH1A1SRD5A2HDAC1ATML3MBTL1
SCHEMBL5535431 0.87 ALDH1A1 (0.56) ALDH1A1SRD5A2HDAC1ATML3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11746187-B2 Compound, resin, polycarbonate resin, and optical molded article MITSUI CHEMICALS, INC. (JP) 2023-09-05 US disclosed
US-20230022186-A1 COMPOUND, RESIN, POLYCARBONATE RESIN, AND OPTICAL MOLDED ARTICLE MITSUI CHEMICALS, INC. (JP) 2023-01-26 US disclosed
US-20220024951-A1 Transition Metal Compound and Catalyst Composition Comprising Same LG CHEM, LTD. (KR) 2022-01-27 US disclosed
US-6190580-B1 DIARYL-NAPHTHOPYRAN PHOTOCHROMIC SUBSTANCE OF GIVEN LINKAGE FORMULA WHICH HAVE A REDUCED TENDENCY TO MIGRATE IN PLASTICS; COMPOUNDS MADE BY ACYLATION FOLLOWED BY NUCLEOPHILIC ADDITION OF METAL ACETYLIDE AND CONDENSATION WITH A DIARYL ALCOHOL OPTISCHE WERKE G. RODENSTOCK (DE) 2001-02-20 US disclosed
US-6036890-A STABLE PHOTOCHROMIC DYE; SUNGLASS LENSES OPTISCHE WERKE G. RODENSTOCK (DE) 2000-03-14 US disclosed
US-5998496-A ABSORBING RADIATION SPECTRA GROUP LIMITED, INC. (US) 1999-12-07 US disclosed
EP-0871607-A4 PHOTOSENSITIVE INTRAMOLECULAR ELECTRON TRANSFER COMPOUNDS SPECTRA GROUP LTD INC (US) 1999-09-29 EP disclosed
EP-0770116-B1 DIARYL-2H-NAPHTHOPYRANES RODENSTOCK OPTIK G (DE) 1999-09-22 EP disclosed
US-5952515-A PHOTOCHROMIC SUBSTANCE HAS AN ARYL SUBSTITUENT WHICH REDUCES THE MIGRATION OF THE MOLECULES IN PLASTICS OPTISCHE WERKE G. RODENSTOCK (DE) 1999-09-14 US disclosed
EP-0686685-B1 Photochromic dye RODENSTOCK OPTIK G (DE) 1998-12-02 EP disclosed
EP-0871607-A1 PHOTOSENSITIVE INTRAMOLECULAR ELECTRON TRANSFER COMPOUNDS SPECTRA GROUP LIMITED INC (US) 1998-10-21 EP disclosed
WO-1997016406-A1 PHOTOSENSITIVE INTRAMOLECULAR ELECTRON TRANSFER COMPOUNDS SPECTRA GROUP LIMITED, INC. (US) 1997-05-09 WO disclosed
EP-0770116-A1 DIARYL-2H-NAPHTHOPYRANES Optische Werke G. Rodenstock (DE) 1997-05-02 EP disclosed
WO-1996001884-A1 DIARYL-2H-NAPHTHOPYRANES OPTISCHE WERKE G. RODENSTOCK (DE) 1996-01-25 WO disclosed
EP-0686685-A2 Photochromic dye Optische Werke G. Rodenstock (DE) 1995-12-13 EP 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 (3 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-11746187-B2 Compound, resin, polycarbonate resin, and optical molded article ARL1, RER1, SEM1 ALDH1A1 1237/4885SRD5A2 253/4885HDAC1 1242/4885
US-20230022186-A1 COMPOUND, RESIN, POLYCARBONATE RESIN, AND OPTICAL MOLDED ARTICLE ARL1, RER1, SEM1 ALDH1A1 1237/4885SRD5A2 253/4885HDAC1 1242/4885
US-20220024951-A1 Transition Metal Compound and Catalyst Composition Comprising Same TRMT1, MRM1, EMG1 ALDH1A1 175/4885SRD5A2 1932/4885HDAC1 777/4885

“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.