SCHEMBL2585951

SCHEMBL2585951

CCOc1ccc(C=O)cc1F

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 12/20 0.60
HPGD P15428 3/20 0.55
MEN1 O00255 1/20 0.55
POLB P06746 1/20 0.55
KMT2A Q03164 1/20 0.55
TUBB1 Q9H4B7 1/20 0.54
TACR2 P21452 1/20 0.52
TDP1 Q9NUW8 2/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
MAPT P10636 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
FDPS P14324 1/20 0.49
KDM4E B2RXH2 1/20 0.48
TSHR P16473 1/20 0.47
KDM1A O60341 2/20 0.46
AOX1 Q06278 1/20 0.43
GAA P10253 1/20 0.43
DHFR P00374 1/20 0.42

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
SCHEMBL1443525 0.86 FDPS (0.54) ALDH1A1HPGDMEN1POLBKMT2A
SCHEMBL29958206 0.86 ALDH1A1 (0.65) ALDH1A1HPGDMEN1POLBKMT2A
SCHEMBL1121313 0.86 ALDH1A1 (0.65) ALDH1A1HPGDMEN1POLBKMT2A
SCHEMBL20489952 0.85 FDPS (0.54) ALDH1A1HPGDMEN1POLBKMT2A
SCHEMBL10291447 0.85 FDPS (0.53) ALDH1A1HPGDMEN1POLBKMT2A
SCHEMBL18733594 0.84 ALDH1A1 (0.51) ALDH1A1HPGDMEN1POLBKMT2A
SCHEMBL30159697 0.83 ALDH1A1 (0.73) ALDH1A1HPGDKMT2ATACR2TDP1
SCHEMBL493684 0.83 ALDH1A1 (0.73) ALDH1A1HPGDKMT2ATACR2TDP1
SCHEMBL2610707 0.83 ALDH1A1 (0.56) ALDH1A1HPGDMEN1POLBKMT2A
SCHEMBL30209172 0.82 THRA (0.51) ALDH1A1HPGDMEN1POLBKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4619097-A1 AUTOPHAGY INDUCING COMPOUNDS AND USES THEREOF Samsara Therapeutics Inc. (US) 2025-09-24 EP disclosed
WO-2024107434-A1 AUTOPHAGY INDUCING COMPOUNDS AND USES THEREOF Samsara Therapeutics Inc. (US) 2024-05-23 WO disclosed
US-11685725-B2 YAP1 inhibitors that target the interaction of YAP1 with OCT4 H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. (US) 2023-06-27 US disclosed
US-11685725-B2 YAP1 inhibitors that target the interaction of YAP1 with OCT4 H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. (US) 2023-06-27 US disclosed
CN-116251081-A 3-arylindenone compounds and pharmaceutical uses thereof 复旦大学 2023-06-13 CN disclosed
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed
US-20210363128-A1 YAP1 INHIBITORS THAT TARGET THE INTERACTION OF YAP1 WITH OCT4 H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. 2021-11-25 US disclosed
WO-2019178401-A1 YAP1 INHIBITORS THAT TARGET THE INTERACTION OF YAP1 WITH OCT4 H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. (US) 2019-09-19 WO disclosed
US-9394272-B2 1,3-dioxane compound having fluorine atom in axial position, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2016-07-19 US disclosed
US-20150368225-A1 1,3-DIOXANE COMPOUND HAVING FLUORINE ATOM IN AXIAL POSITION, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2015-12-24 US disclosed
WO-2004026305-A1 DIARYL ETHERS AS OPIOID RECEPTOR ANTAGONIST ELI LILLY AND COMPANY (US) 2004-04-01 WO disclosed
CN-1449368-A Method of producing fluorinated and chlorinated benzaldehydes and compositions thereof MILLIKEN & CO (US) 2003-10-15 CN disclosed
US-20030176481-A1 Novel imidazole derivatives with anti-inflammatory activity J. URIACH & CIA S.A. (ES) 2003-09-18 US disclosed
EP-1313691-A2 FLUORINATED AND CHLORINATED BENZALDEHYDES Milliken & Company (US) 2003-05-28 EP disclosed
EP-1313690-A1 METHOD OF PRODUCING FLUORINATED AND CHLORINATED BENZALDEHYDES AND COMPOSITIONS THEREOF Milliken & Company (US) 2003-05-28 EP disclosed
EP-1270559-A1 NOVEL IMIDAZOLE DERIVATIVES WITH ANTI-INFLAMMATORY ACTIVITY J. URIACH & CIA. S.A. (ES) 2003-01-02 EP disclosed
WO-2002020452-A2 NOVEL FLUORINATED AND CHLORINATED BENZALDEHYDES MILLIKEN & COMPANY (US) 2002-03-14 WO disclosed
WO-2002020447-A1 METHOD OF PRODUCING FLUORINATED AND CHLORINATED BENZALDEHYDES AND COMPOSITIONS THEREOF MILLIKEN & COMPANY (US) 2002-03-14 WO disclosed
US-6300525-B1 CONTACTING SUBSTITUTED BENZENE IN CARBON MONOXIDE ATMOSPHERE HAVING SPECIFIED PRESSURE IN PRESENCE OF METAL HALIDE AND HYDROHALIC ACID CATALYST AND AT SPECIFIED TEMPERATURE MILLIKEN & COMPANY 2001-10-09 US disclosed
US-6297405-B1 EFFICIENTLY PRODUCED BENZALDEHYDE CHEMICAL INTERMEDIATE SUBSTITUTED BY ONE HALOGEN AND ALKYL OR CYCLOALKYL GROUPS AT OTHER POSITIONS MILLIKEN & COMPANY 2001-10-02 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 (4 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-11685725-B2 YAP1 inhibitors that target the interaction of YAP1 with OCT4 YAP1, YES1, MYC ALDH1A1 3176/4885HPGD 4716/4885MEN1 3614/4885
US-20030176481-A1 Novel imidazole derivatives with anti-inflammatory activity IL1B, IL1A, MIF ALDH1A1 394/4885HPGD 94/4885MEN1 4771/4885
US-20210363128-A1 YAP1 INHIBITORS THAT TARGET THE INTERACTION OF YAP1 WITH OCT4 YAP1, MYC, YES1 ALDH1A1 3004/4885HPGD 4719/4885MEN1 3627/4885
US-20150368225-A1 1,3-DIOXANE COMPOUND HAVING FLUORINE ATOM IN AXIAL POSITION, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE CXCR1, HAX1, RCC1 ALDH1A1 1040/4885HPGD 4652/4885MEN1 1482/4885

“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.