SCHEMBL2631833

SCHEMBL2631833

COC1OC(=O)c2ccccc21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.48
KDM4E B2RXH2 4/20 0.44
HSD17B10 Q99714 1/20 0.44
LMNA P02545 2/20 0.40
POLB P06746 3/20 0.40
TSHR P16473 1/20 0.39
HTT P42858 1/20 0.39
MAP2K7 O14733 1/20 0.39
GMNN O75496 1/20 0.39
TP53 P04637 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
MAPT P10636 1/20 0.39
CYP2C9 P11712 1/20 0.39
HPGD P15428 1/20 0.39
ALOX15 P16050 1/20 0.39
CDC25A P30304 1/20 0.39
CDC25B P30305 1/20 0.39
CYP2C19 P33261 1/20 0.39

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
SCHEMBL9910017 0.85 ALDH1A1 (0.46) ALDH1A1KDM4EHSD17B10LMNAPOLB
SCHEMBL29441612 0.83 ALDH1A1 (0.52) ALDH1A1KDM4EHSD17B10POLBALOX15
SCHEMBL11213802 0.83 ALDH1A1 (0.52) ALDH1A1KDM4EHSD17B10POLBALOX15
SCHEMBL8577595 0.81 ALDH1A1 (0.46) ALDH1A1KDM4EHSD17B10LMNAPOLB
SCHEMBL17687693 0.80 KDM4E (0.42) ALDH1A1KDM4EHSD17B10LMNACYP1A2
SCHEMBL15826903 0.80 ALDH1A1 (0.33) ALDH1A1KDM4EHSD17B10LMNAPOLB
SCHEMBL13292304 0.79 ALDH1A1 (0.44) ALDH1A1KDM4EHSD17B10LMNAPOLB
SCHEMBL13302911 0.79 POLB (0.45) ALDH1A1KDM4EHSD17B10POLBTSHR
SCHEMBL232522 0.79 ALDH1A1 (0.44) ALDH1A1KDM4EHSD17B10LMNAPOLB
SCHEMBL30408659 0.79 POLB (0.45) ALDH1A1KDM4EHSD17B10POLBTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230233551-A1 COMPOSITIONS AND METHODS FOR TREATMENT CITIBANK, N.A., AS NOTES COLLATERAL AGENT 2023-07-27 US disclosed
US-20230233551-A1 COMPOSITIONS AND METHODS FOR TREATMENT CITIBANK, N.A., AS NOTES COLLATERAL AGENT 2023-07-27 US disclosed
US-11691957-B2 Condensed cyclic compound and organic light-emitting device including the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2023-07-04 US disclosed
US-11691957-B2 Condensed cyclic compound and organic light-emitting device including the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2023-07-04 US disclosed
US-RE49569-E1 Alkylamine derivative EA PHARMA CO., LTD. (JP) 2023-07-04 US disclosed
US-11691957-B2 Condensed cyclic compound and organic light-emitting device including the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2023-07-04 US disclosed
US-20210338839-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF DIABETIC RETINOPATHY NOVARTIS AG (CH) 2021-11-04 US disclosed
US-20210198222-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2021-07-01 US disclosed
US-20210198222-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2021-07-01 US disclosed
EP-3797775-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF DIABETIC RETINOPATHY Novartis AG (CH) 2021-03-31 EP disclosed
US-7358254-B2 Method for treating atherosclerosis employing an aP2 inhibitor and combination BRISTOL-MYERS SQUIBB COMPANY (US) 2008-04-15 US disclosed
US-20070031514-A1 Use of isoindolinone derivatives as insecticides BAYER CROPSCIENCE AG (DE) 2007-02-08 US disclosed
US-20070031514-A1 Use of isoindolinone derivatives as insecticides BAYER CROPSCIENCE AG (DE) 2007-02-08 US disclosed
US-6103912-A OPTICAL INFRARED FILTERS COMPRISING PH SENSITIVE DYES POLAROID CORPORATION (US) 2000-08-15 US disclosed
EP-0553346-B1 PHOTOGRAPHIC PRODUCTS AND PROCESSES POLAROID CORP (US) 1998-01-28 EP disclosed
US-5244771-A Bridged indicator dyes used as light-absorbing, pH-sensitive optical filter agents in diffusion transfer POLAROID CORPORATION (US) 1993-09-14 US disclosed
EP-0553346-A1 PHOTOGRAPHIC PRODUCTS AND PROCESSES POLAROID CORPORATION (US) 1993-08-04 EP disclosed
WO-1993004403-A1 PHOTOGRAPHIC PRODUCTS AND PROCESSES POLAROID CORPORATION (US) 1993-03-04 WO disclosed
US-4835312-A Production process of N-substituted amide compounds MITSUI CHEMICALS, INCORPORATED (JP) 1989-05-30 US disclosed
US-4211711-A Method of preparing phthalide DYNAMIT NOBEL AKTIENGESELLSCHAFT (DE) 1980-07-08 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 (5 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-20070031514-A1 Use of isoindolinone derivatives as insecticides DDT, CYP1A2, CYP1A1 ALDH1A1 47/4885KDM4E 3128/4885HSD17B10 821/4885
US-20210198222-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, CCNT1, CCNA1 ALDH1A1 354/4885KDM4E 4156/4885HSD17B10 2746/4885
US-11691957-B2 Condensed cyclic compound and organic light-emitting device including the same CRY1, CCNT1, CCNA1 ALDH1A1 354/4885KDM4E 4156/4885HSD17B10 2746/4885
US-20230233551-A1 COMPOSITIONS AND METHODS FOR TREATMENT ICAM1, VCAM1, ITGAL ALDH1A1 116/4885KDM4E 2998/4885HSD17B10 3634/4885
US-20210338839-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF DIABETIC RETINOPATHY VCAM1, ITGB1, ICAM1 ALDH1A1 164/4885KDM4E 2791/4885HSD17B10 3181/4885

“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.