SCHEMBL1146705

SCHEMBL1146705

CC1(C)CC(=O)c2c(O)cc(O)cc2O1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 1.00
KDM4E B2RXH2 2/20 0.58
RAB9A P51151 5/20 0.57
NPC1 O15118 4/20 0.57
LMNA P02545 2/20 0.57
SMN1; SMN2 Q16637 2/20 0.57
GAA P10253 1/20 0.57
HPGD P15428 1/20 0.57
HTT P42858 1/20 0.57
PTPN1 P18031 3/20 0.56
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
MAPT P10636 2/20 0.54
TSHR P16473 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
MITF O75030 1/20 0.51
NR2F2 P24468 1/20 0.51

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
SCHEMBL3030839 0.85 ALDH1A1 (0.74) ALDH1A1KDM4ERAB9ANPC1LMNA
SCHEMBL20116002 0.85 ALDH1A1 (0.74) ALDH1A1KDM4ERAB9ANPC1LMNA
SCHEMBL10482619 0.84 ALDH1A1 (0.72) ALDH1A1KDM4ERAB9ANPC1LMNA
SCHEMBL11380576 0.81 ALDH1A1 (0.68) ALDH1A1KDM4ERAB9ANPC1LMNA
SCHEMBL4506446 0.81 ALDH1A1 (0.68) ALDH1A1KDM4ERAB9ANPC1LMNA
SCHEMBL4508215 0.80 ALDH1A1 (0.67) ALDH1A1KDM4ERAB9ANPC1LMNA
SCHEMBL13481990 0.80 ALDH1A1 (0.66) ALDH1A1KDM4ERAB9ANPC1LMNA
SCHEMBL4518634 0.79 ALDH1A1 (0.65) ALDH1A1KDM4ERAB9ANPC1LMNA
SCHEMBL30593801 0.79 ALDH1A1 (0.65) ALDH1A1KDM4ERAB9ANPC1LMNA
SCHEMBL10367142 0.78 ALDH1A1 (0.63) ALDH1A1KDM4ERAB9ANPC1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115215879-B 3-aryl-4, 5-pyranocoumarin derivative, and preparation method and application thereof 广西中医药大学 2023-10-20 CN claimed
CN-115322204-B Preparation method and application of radix glycyrrhizae glabra A and derivatives thereof 广西中医药大学 2023-09-19 CN claimed
CN-115215879-B 3-aryl-4, 5-pyranocoumarin derivative, and preparation method and application thereof 广西中医药大学 2023-10-20 CN disclosed
CN-115322204-B Preparation method and application of radix glycyrrhizae glabra A and derivatives thereof 广西中医药大学 2023-09-19 CN disclosed
CN-115322204-A Preparation method and application of glabrous greenbrier rhizome A and derivatives thereof 广西中医药大学 2022-11-11 CN disclosed
EP-2254601-B1 OLIGOMER-CANNABINOID CONJUGATES NEKTAR THERAPEUTICS (US) 2019-05-29 EP disclosed
US-9155797-B2 Oligomer-cannabinoid conjugates NEKTAR THERAPEUTICS (US) 2015-10-13 US disclosed
US-9155797-B2 Oligomer-cannabinoid conjugates NEKTAR THERAPEUTICS (US) 2015-10-13 US disclosed
US-20140329895-A1 OLIGOMER-CANNABINOID CONJUGATES NEKTAR THERAPEUTICS 2014-11-06 US disclosed
US-20140329895-A1 OLIGOMER-CANNABINOID CONJUGATES NEKTAR THERAPEUTICS 2014-11-06 US disclosed
US-8829043-B2 Oligome-cannabinoid conjugates NEKTAR THERAPEUTICS (US) 2014-09-09 US disclosed
US-4863934-A Bicyclic benzo fused pyran compounds used for producing analgesia PFIZER INC. (US) 1989-09-05 US disclosed
US-4841078-A ANALGESICS PFIZER INC. (US) 1989-06-20 US disclosed
EP-0129636-B1 PROCESS FOR THE PREPARATION OF CHROMEN DERIVATIVES ALKALOIDA VEGYéSZETI GYáR (HU) 1989-01-04 EP disclosed
US-4680404-A ANALGESICS, TRANQUILIZERS, ANTIEMETICS, DIURETICS, ANTICONVULSANTS PFIZER INC. (US) 1987-07-14 US disclosed
EP-0129636-A1 Process for the preparation of chromen derivatives ALKALOIDA VEGYéSZETI GYáR (HU) 1985-01-02 EP disclosed
US-4486428-A ANALGESICS, ANTIEMETICS PFIZER INC. (US) 1984-12-04 US disclosed
EP-0089781-A2 Bicyclic benzo fused compounds PFIZER INC. (US) 1983-09-28 EP disclosed
US-4243674-A HYPOTENSIVE AGENTS; ANALGESICS; ANTISECRETORY AGENTS; ANTIBODY INHIBITORS, AND TRANQUILIZERS PFIZER INC. (US) 1981-01-06 US disclosed
US-4143139-A ANALGESICS, HYPOTENSIVES, IMMUNOSUPPRESSANTS, TRANQUILIZERS, ANTISECRETORY, ANTI-ANXIETY PFIZER INC. (US) 1979-03-06 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 (1 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-20140329895-A1 OLIGOMER-CANNABINOID CONJUGATES CNR2, CNR1, OPRL1 ALDH1A1 3706/4885KDM4E 3026/4885RAB9A 1707/4885

“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.