SCHEMBL1800067

SCHEMBL1800067

O=C1Cc2ccc(Cl)cc2C1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
METAP1 P53582 1/20 0.52
CYP1A2 P05177 1/20 0.50
AHR P35869 2/20 0.48
CMA1 P23946 1/20 0.48
HTR2A P28223 1/20 0.43
HTR2C P28335 1/20 0.43
HTR2B P41595 1/20 0.43
F7 P08709 1/20 0.41
PARP1 P09874 1/20 0.41
F3 P13726 1/20 0.41
PARP10 Q53GL7 1/20 0.41
PNMT P11086 1/20 0.41
S100A4 P26447 1/20 0.39
HSP90AA1 P07900 1/20 0.39
CYP2A6 P11509 1/20 0.38
NOTUM Q6P988 2/20 0.38
TDP2 O95551 1/20 0.38
PDE3B Q13370 1/20 0.38
PDE3A Q14432 1/20 0.38
SRD5A1 P18405 2/20 0.36

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
SCHEMBL6904514 0.85 HTR2A (0.50) METAP1AHRCMA1HTR2AHTR2C
SCHEMBL588130 0.85 CYP2A6 (0.54) METAP1CYP1A2AHRCMA1HTR2A
SCHEMBL3269917 0.85 CYP2A6 (0.54) METAP1CYP1A2AHRCMA1HTR2A
SCHEMBL30748374 0.85 CYP2A6 (0.54) METAP1CYP1A2AHRCMA1HTR2A
Bromide SCHEMBL189011 0.82
Ammonia Solution, Strong SCHEMBL1325642 0.82
SCHEMBL5143608 0.81 HTR2A (0.46) METAP1AHRCMA1HTR2AHTR2C
SCHEMBL12430509 0.81 HTR2A (0.46) METAP1CYP1A2AHRCMA1HTR2A
Hydrochloric Acid SCHEMBL8894992 0.80 HTR2A (0.46) METAP1AHRCMA1HTR2AHTR2C
SCHEMBL10463438 0.79 AHR (0.50) METAP1CYP1A2AHRCMA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12590087-B2 Inhibiting USP36 VALO HEALTH, INC. (US) 2026-03-31 US disclosed
CN-114222574-B Inhibition of USP36 瓦洛健康股份有限公司 2024-12-17 CN disclosed
EP-4126855-B1 COMPOUNDS AND THEIR USE IN THE TREATMENT OF BACTERIAL INFECTIONS HOFFMANN LA ROCHE (CH) 2024-04-24 EP disclosed
US-20230381132-A1 NOVEL COMPOUNDS SITRYX THERAPEUTICS LIMITED (GB) 2023-11-30 US disclosed
US-20230381132-A1 NOVEL COMPOUNDS SITRYX THERAPEUTICS LIMITED (GB) 2023-11-30 US disclosed
US-20230381132-A1 NOVEL COMPOUNDS SITRYX THERAPEUTICS LIMITED (GB) 2023-11-30 US disclosed
EP-3337497-B1 COMPOSITION AND METHODS OF USE OF NOVEL PHENYLALANINE SMALL ORGANIC COMPOUNDS TO DIRECTLY MODULATE PCSK9 PROTEIN ACTIVITY SRX CARDIO LLC (US) 2023-07-12 EP disclosed
US-20230167127-A1 COMPOUNDS AND THEIR USE IN THE TREATMENT OF BACTERIAL INFECTION HOFFMANN-LA ROCHE INC. (US) 2023-06-01 US disclosed
US-20220213088-A1 INHIBITING USP36 Valo Health, LLC 2022-07-07 US disclosed
US-20220213088-A1 INHIBITING USP36 Valo Health, LLC 2022-07-07 US disclosed
EP-0861837-A1 2-Aminoindane derivatives, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1998-09-02 EP disclosed
EP-0137333-B1 SPIRO-TRICYCLICAROMATIC SUCCINIMIDE DERIVATIVES AS INHIBITORS OF ALDOSE REDUCTASE ALCON LABORATORIES, INC. (US) 1992-12-30 EP disclosed
US-5153211-A Enzyme inhibitors ALCON LABORATORIES, INC. (US) 1992-10-06 US disclosed
US-5070100-A COMPLICATIONS OF DIABETES ALCON LABORATORIES, INC. (US) 1991-12-03 US disclosed
US-4864028-A ANTIDIABETIC AGENTS ALCON LABORATORIES, INC. (US) 1989-09-05 US disclosed
US-4537892-A ANTIDIABETIC AGENTS ALCON LABORATORIES, INC. (US) 1985-08-27 US disclosed
EP-0137333-A2 Spiro-tricyclicaromatic succinimide derivatives as inhibitors of aldose reductase ALCON LABORATORIES, INC. (US) 1985-04-17 EP disclosed
US-4217302-A INSECTICIDES, MITICIDES ZOECON CORPORATION (US) 1980-08-12 US disclosed
US-4192888-A Pharmaceutical compositions and method of inhibiting phenylethanolamine N-methyltransferase SMITHKLINE CORPORATION (US) 1980-03-11 US disclosed
US-4189598-A INSECTICIDES., MITICIDE ZOECON CORPORATION (US) 1980-02-19 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-20230381132-A1 NOVEL COMPOUNDS CNKSR1, RORC, RCOR3 METAP1 2540/4885CYP1A2 355/4885AHR 735/4885
US-20220213088-A1 INHIBITING USP36 USP36, USP30, USP39 METAP1 2578/4885CYP1A2 3442/4885AHR 3113/4885
US-20230167127-A1 COMPOUNDS AND THEIR USE IN THE TREATMENT OF BACTERIAL INFECTION LTB4R, C5, C3AR1 METAP1 3538/4885CYP1A2 408/4885AHR 2351/4885
US-12590087-B2 Inhibiting USP36 USP36, USP39, USP30 METAP1 3316/4885CYP1A2 3140/4885AHR 1779/4885

“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.