SCHEMBL1010516

SCHEMBL1010516

COC(=O)C(CC(=O)O)=C(c1ccccc1)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.48
ESRRB O95718 2/20 0.43
NR4A2 P43354 1/20 0.42
KMT2A Q03164 3/20 0.42
ALOX15 P16050 2/20 0.42
HPGD P15428 2/20 0.42
MEN1 O00255 2/20 0.42
CES1 P23141 2/20 0.42
KDM4E B2RXH2 1/20 0.42
CYP3A4 P08684 1/20 0.42
MAPT P10636 1/20 0.42
MAPK1 P28482 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
HDAC3 O15379 1/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
IDO1 P14902 1/20 0.41
HDAC1 Q13547 1/20 0.41
CA9 Q16790 1/20 0.41

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
SCHEMBL9899633 0.92 SMN1; SMN2 (0.47) HPGDMAPTMAPK1SMN1; SMN2HDAC3
SCHEMBL9899631 0.92 SMN1; SMN2 (0.47) HPGDMAPTMAPK1SMN1; SMN2HDAC3
SCHEMBL3267872 0.91 NPC1 (0.44) TSHRESRRBKMT2AHPGDMEN1
SCHEMBL6555910 0.91 CES2 (0.56) KMT2ACES1KDM4ESMN1; SMN2CA1
SCHEMBL6555908 0.91 CES2 (0.56) KMT2ACES1KDM4ESMN1; SMN2CA1
SCHEMBL3267871 0.91 NPC1 (0.44) TSHRESRRBKMT2AHPGDMEN1
SCHEMBL1331949 0.87 CA12 (0.51) TSHRKMT2AHPGDMEN1KDM4E
SCHEMBL1331951 0.87 CA12 (0.51) TSHRKMT2AHPGDMEN1KDM4E
SCHEMBL3264549 0.86 ALDH1A1 (0.50) KMT2AMEN1CES1KDM4EMAPT
SCHEMBL24620799 0.84 ALDH1A1 (0.53) TSHRKMT2AMEN1KDM4EMAPT

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 42 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3898590-B1 METHOD FOR PREPARING INDOLENAPHTHOPYRANS TRANSITIONS OPTICAL LTD (IE) 2023-11-22 EP disclosed
EP-3898636-B9 INDOLONAPHTHOPYRANS TRANSITIONS OPTICAL LTD (IE) 2023-11-08 EP disclosed
EP-3898636-B1 INDOLONAPHTHOPYRANS TRANSITIONS OPTICAL LTD (IE) 2023-08-30 EP disclosed
US-20220073533-A1 Method for Preparing Indolenaphthopyrans TRANSITIONS OPTICAL, LTD. (IE) 2022-03-10 US disclosed
US-20220056039-A1 Indolonaphthopyrans TRANSITIONS OPTICAL, LTD. (IE) 2022-02-24 US disclosed
WO-2020126032-A1 INDOLONAPHTHOPYRANS TRANSITIONS OPTICAL, LTD. (IE) 2020-06-25 WO disclosed
WO-2020126033-A1 METHOD FOR PREPARING INDOLENAPHTHOPYRANS TRANSITIONS OPTICAL, LTD. (IE) 2020-06-25 WO disclosed
US-9643905-B2 Phenylnaphthol derivatives TOKUYAMA CORPORATION (JP) 2017-05-09 US disclosed
US-9643905-B2 Phenylnaphthol derivatives TOKUYAMA CORPORATION (JP) 2017-05-09 US disclosed
US-20160130203-A1 NOVEL PHENYLNAPHTHOL DERIVATIVES TOKUYAMA CORPORATION (JP) 2016-05-12 US disclosed
US-5955520-A 1H-INDENO(2,1-F)NAPHTHO(1,2-B)PYRANS HAVING ACTIVATED COLORS RANGING FROM ORANGE TO BLUE/GRAY, AN ACCEPTABLE FADE RATE, HIGH ACTIVATED COLORS RANGING FROM ORGANE TO BLUE/GRAY, AN ACCEPTABLE FAD RATE, HIGH ACTIVATED INTENSITY PPG INDUSTRIES, INC. (US) 1999-09-21 US disclosed
EP-0906366-A1 NOVEL PHOTOCHROMIC INDENO-FUSED NAPHTHOPYRANS TRANSITIONS OPTICAL, INC. (US) 1999-04-07 EP disclosed
EP-0792468-A4 NOVEL PHOTOCHROMIC INDENO-FUSED NAPHTHOPYRANS PPG INDUSTRIES INC (US) 1999-03-03 EP disclosed
EP-0835870-A1 Photochromic substituted naphthopyrans PPG INDUSTRIES, INC. (US) 1998-04-15 EP disclosed
WO-1998014443-A1 NOVEL SUBSTITUTED NAPHTHOPYRANS PPG INDUSTRIES, INC. (US) 1998-04-09 WO disclosed
WO-1997048762-A1 NOVEL PHOTOCHROMIC INDENO-FUSED NAPHTHOPYRANS TRANSITIONS OPTICAL, INC. (US) 1997-12-24 WO disclosed
EP-0792468-A1 NOVEL PHOTOCHROMIC INDENO-FUSED NAPHTHOPYRANS PPG INDUSTRIES, INC. (US) 1997-09-03 EP disclosed
US-5656206-A OPHTHALIMIC LENSES; RADIATION TRANSPARENT; PHOTOCHROMISM TRANSITIONS OPTICAL, INC. (US) 1997-08-12 US disclosed
US-5645767-A PLASTIC LENSES, WINDOWS, BATHOCHROMIC SHIFT FOR WAVELENGTHS IN VISIBLE SPECTRUM TRANSITIONS OPTICAL, INC. (US) 1997-07-08 US disclosed
WO-1996014596-A1 NOVEL PHOTOCHROMIC INDENO-FUSED NAPHTHOPYRANS PPG INDUSTRIES, INC. (US) 1996-05-17 WO 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-20160130203-A1 NOVEL PHENYLNAPHTHOL DERIVATIVES AHR, ARL1, PAH TSHR 2179/4885ESRRB 2720/4885NR4A2 187/4885
US-20220056039-A1 Indolonaphthopyrans TPH1, TPH2, IDO1 TSHR 514/4885ESRRB 1134/4885NR4A2 1718/4885
US-20220073533-A1 Method for Preparing Indolenaphthopyrans CCNH, CCNT1, PAH TSHR 1331/4885ESRRB 3983/4885NR4A2 3169/4885

“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.