SCHEMBL6620764

SCHEMBL6620764

CC1CC(O)c2ccccc2O1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.43
MAOB P27338 4/20 0.41
MAOA P21397 2/20 0.41
BRD4 O60885 1/20 0.38
CREBBP Q92793 1/20 0.38
ABCB1 P08183 2/20 0.37
AKR1B1 P15121 1/20 0.36
GUSB P08236 4/20 0.35
ESR1 P03372 1/20 0.33
ESR2 Q92731 1/20 0.33
LTB4R Q15722 1/20 0.33
LTB4R2 Q9NPC1 1/20 0.33
MAP3K14 Q99558 1/20 0.33

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
Hydrochloric Acid SCHEMBL27510735 0.98 POLB (0.42) POLBMAOBMAOABRD4CREBBP
SCHEMBL18614556 0.80 MAOA (0.37) POLBMAOBMAOAABCB1GUSB
SCHEMBL30703071 0.80 POLB (0.44) POLBMAOBMAOABRD4CREBBP
SCHEMBL1328841 0.77 POLB (0.43) POLBMAOBMAOABRD4CREBBP
SCHEMBL18383190 0.77 POLB (0.43) POLBMAOBMAOABRD4CREBBP
SCHEMBL18383187 0.77 POLB (0.43) POLBMAOBMAOABRD4CREBBP
SCHEMBL28019281 0.77 MAOB (0.41) MAOBMAOAABCB1GUSBESR1
SCHEMBL10764252 0.77 MAOA (0.41) MAOBMAOAGUSBESR1ESR2
SCHEMBL24997237 0.75 MAP3K14 (0.41) POLBAKR1B1MAP3K14
SCHEMBL24997234 0.75 MAP3K14 (0.41) POLBAKR1B1MAP3K14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100338060-C New use of substituted aminomethyl chromans MERCK PATENT GMBH (DE) 2007-09-19 CN claimed
US-20240018133-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ABBVIE INC. 2024-01-18 US disclosed
US-20210363136-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ABBVIE INC. 2021-11-25 US disclosed
WO-2020223536-A1 SUBSTITUTED CYCLOLAKYLS AS MODULATORS OF THE INTEGRATED STRESS PATHWAY CALICO LIFE SCIENCES LLC (US) 2020-11-05 WO disclosed
US-20200347043-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ABBVIE INC. 2020-11-05 US disclosed
CN-1249044-C Chromanone derivatives MERCK PATENT GMBH (DE) 2006-04-05 CN disclosed
EP-1434777-A1 BENZISOTHIAZOLYL-SUBSTITUTED AMINOMETHYL CHROMANES FOR TREATING DISEASES OF THE CENTRAL NERVOUS SYSTEM Bayer HealthCare AG (DE) 2004-07-07 EP disclosed
CN-1451001-A Chromanone derivatives MERCK PATENT GMBH (DE) 2003-10-22 CN disclosed
WO-2003029250-A1 BENZISOTHIAZOLYL-SUBSTITUTED AMINOMETHYL CHROMANES FOR TREATING DISEASES OF THE CENTRAL NERVOUS SYSTEM BAYER HEALTHCARE AG (DE) 2003-04-10 WO disclosed
CN-1254335-A Nicotinamide derivatives PFIZER PROD INC (US) 2000-05-24 CN 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-20210363136-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ATF4, ATF1, DDIT3 POLB 1759/4885MAOB 3069/4885MAOA 3585/4885
US-20240018133-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ATF4, ATF1, DDIT3 POLB 1759/4885MAOB 3069/4885MAOA 3585/4885
US-20200347043-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ATF4, ATF1, DDIT3 POLB 1759/4885MAOB 3069/4885MAOA 3585/4885

“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.