SCHEMBL5196128

SCHEMBL5196128

Cc1oc2cc(O)ccc2c1C

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B3 P37058 7/20 0.67
KDM4E B2RXH2 8/20 0.61
ALDH1A1 P00352 7/20 0.61
HSD17B10 Q99714 5/20 0.61
LMNA P02545 2/20 0.61
MAPT P10636 1/20 0.61
ALOX15 P16050 1/20 0.61
HTT P42858 1/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
CA2 P00918 1/20 0.57
GAA P10253 6/20 0.56
HPGD P15428 5/20 0.56
GLA P06280 5/20 0.56
CASP1 P29466 2/20 0.55
CASP7 P55210 2/20 0.55
CA12 O43570 1/20 0.55
CYP1A2 P05177 1/20 0.55
CYP2C9 P11712 1/20 0.55
AKR1B1 P15121 1/20 0.55
UGT1A1 P22309 1/20 0.55

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
SCHEMBL3956317 0.85 ALDH1A1 (0.67) HSD17B3KDM4EALDH1A1HSD17B10LMNA
SCHEMBL12301447 0.83 LMNA (0.51) HSD17B3KDM4EALDH1A1HSD17B10LMNA
SCHEMBL591899 0.80 HSD17B3 (1.00) HSD17B3KDM4EALDH1A1HSD17B10LMNA
SCHEMBL31366988 0.80 HSD17B3 (1.00) HSD17B3KDM4EALDH1A1HSD17B10LMNA
SCHEMBL28446883 0.79 HSD17B3 (0.96) HSD17B3KDM4EALDH1A1HSD17B10LMNA
SCHEMBL12489574 0.78 ALDH2 (0.48) HSD17B3KDM4EALDH1A1MAPTSMN1; SMN2
SCHEMBL9136261 0.77 ALDH1A1 (0.63) HSD17B3KDM4EALDH1A1HSD17B10LMNA
SCHEMBL14176730 0.77 KDM4E (0.57) HSD17B3KDM4EALDH1A1HSD17B10LMNA
SCHEMBL29600967 0.77 KDM4E (1.00) HSD17B3KDM4EALDH1A1HSD17B10LMNA
SCHEMBL3874542 0.77 KDM4E (1.00) HSD17B3KDM4EALDH1A1HSD17B10LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5730962-A Depigmenting cosmetic or dermatologic composition containing a benzofuran derivative and its use in depigmentating skin L'OREAL (FR) 1998-03-24 US claimed
EP-0524108-B1 Use of derivatives of benzofurane as depigmentation agents in cosmetic or dermatological compositions OREAL (FR) 1995-06-07 EP claimed
WO-2013138744-A1 COMPOSITIONS FOR THE TREATMENT OF SKIN DISORDERS M. ALPHABET 1, LLC (US) 2013-09-19 WO disclosed
EP-1277736-B1 NOVEL BICYCLIC COMPOUNDS ASAHI KASEI PHARMA CORP (JP) 2007-08-08 EP disclosed
EP-1785421-A1 TROPAN COMPOUND ONO PHARMACEUTICAL CO., LTD. (JP) 2007-05-16 EP disclosed
US-7049445-B2 Bicyclic compounds ASAHI KASEI PHARMA CORPORATION (JP) 2006-05-23 US disclosed
US-6861444-B2 Bicyclic compounds ASAHI KASEI PHARMA CORPORATION (JP) 2005-03-01 US disclosed
US-20040127546-A1 for treating or preventing diabetes, obesity, hyperlipidemia, digestive diseases, depression or urinary disturbances; beta 3-agonist ASAHI KASEI PHARMA CORPORATION (JP) 2004-07-01 US disclosed
US-20030191174-A1 Eating disorders; antidiabetic agents; gastrointestinal disorders ASAHI KASEI PHARMA CORPORATION (JP) 2003-10-09 US disclosed
CN-1430603-A Novel bicyclic compounds ASAHI CHEMICAL IND (JP) 2003-07-16 CN disclosed
EP-1277736-A1 NOVEL BICYCLIC COMPOUNDS Asahi Kasei Kabushiki Kaisha (JP) 2003-01-22 EP disclosed
US-5730962-A Depigmenting cosmetic or dermatologic composition containing a benzofuran derivative and its use in depigmentating skin L'OREAL (FR) 1998-03-24 US disclosed
EP-0230475-B1 NOVEL UREA DERIVATIVES, PROCESSES FOR PRODUCTION THEREOF AND HERBICIDE MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1992-03-18 EP disclosed
US-4838924-A NONPHYTOTOXIC MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1989-06-13 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 (2 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-20040127546-A1 for treating or preventing diabetes, obesity, hyperlipidemia, digestive diseases, depression or urinary disturbances; beta 3-agonist GPR119, ADRB3, DBH HSD17B3 45/4885KDM4E 3207/4885ALDH1A1 1438/4885
US-20030191174-A1 Eating disorders; antidiabetic agents; gastrointestinal disorders GPR119, GIPR, SLC5A2 HSD17B3 339/4885KDM4E 1397/4885ALDH1A1 1990/4885

“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.