SCHEMBL5644608

SCHEMBL5644608

CCCC(C)(C)c1cccc(OC)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 3/20 0.52
CNR2 P34972 3/20 0.52
KIF11 P52732 1/20 0.44
ACHE P22303 1/20 0.42
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
ALDH1A1 P00352 1/20 0.41
CYP3A4 P08684 1/20 0.41
CMA1 P23946 1/20 0.40
TAAR1 Q96RJ0 3/20 0.40
IDO1 P14902 2/20 0.40
AGXT P21549 2/20 0.40
DRD2 P14416 1/20 0.40
APP P05067 1/20 0.39
MGLL Q99685 1/20 0.39
MAOB P27338 1/20 0.39
CES2 O00748 1/20 0.38
CES1 P23141 1/20 0.38

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
SCHEMBL5646550 0.90 CNR2 (0.60) CNR1CNR2KIF11ACHE
SCHEMBL14025162 0.87 CNR2 (0.68) CNR1CNR2
SCHEMBL3435840 0.85 KIF11 (0.46) CNR1CNR2KIF11ACHECA1
SCHEMBL22096345 0.84 CNR1 (0.48) CNR1CNR2KIF11ACHECA1
SCHEMBL23057946 0.84 TP53 (0.49) CNR1CNR2ALDH1A1CYP3A4
SCHEMBL18737497 0.83 KIF11 (0.47) CNR1CNR2KIF11
SCHEMBL19455957 0.83 KIF11 (0.42) CNR1CNR2KIF11ACHECA1
SCHEMBL8705771 0.81 KIF11 (0.46) CNR1CNR2KIF11ACHECA1
SCHEMBL25968340 0.81 CNR2 (0.55) CNR1CNR2KIF11ACHECA1
SCHEMBL17129735 0.81 ALDH1A1 (0.46) CNR1CNR2CA1CA2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230285573-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE Design Therapeutics, Inc. 2023-09-14 US disclosed
US-20230226074-A1 METHODS OF USE FOR PYRIMIDINES AS FERROPORTIN INHIBITORS GLOBAL BLOOD THERAPEUTICS INC (US) 2023-07-20 US disclosed
US-20210009549-A1 CANNABINOID DERIVATIVES AND CONJUGATES AND USES THEREOF BEETLEBUNG PHARMA LTD (IL) 2021-01-14 US disclosed
WO-2019159168-A1 CANNABINOID DERIVATIVES AND CONJUGATES AND USES THEREOF BEETLEBUNG PHARMA LTD. (IL) 2019-08-22 WO disclosed
US-7259266-B2 Benzopyran compounds useful for treating inflammatory conditions PHARMACIA CORPORATION (US) 2007-08-21 US disclosed
EP-1631562-A1 CHROMENE DERIVATIVES AS ANTI-INFLAMMATORY AGENTS Pharmacia Corporation (US) 2006-03-08 EP disclosed
EP-1615905-A2 BENZOPYRAN COMPOUNDS USEFUL FOR TREATING INFLAMMATORY CONDITIONS Pharmacia Corporation (US) 2006-01-18 EP disclosed
US-20050148627-A1 Benzopyran compounds for use in the treatment and prevention of inflammation related conditions CARTER JEFFERY (US) 2005-07-07 US disclosed
US-20050148777-A1 Benzopyran compounds useful for treating inflammatory conditions CARTER JEFFERY (US) 2005-07-07 US disclosed
WO-2004087687-A1 CHROMENE DERIVATIVES AS ANTI-INFLAMMATORY AGENTS PHARMACIA CORPORATION (US) 2004-10-14 WO disclosed
WO-2004087686-A2 BENZOPYRAN COMPOUNDS USEFUL FOR TREATING INFLAMMATORY CONDITIONS PHARMACIA CORPORATION (US) 2004-10-14 WO 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-20050148777-A1 Benzopyran compounds useful for treating inflammatory conditions PTGES2, PTGER2, PTGS2 CNR1 71/4885CNR2 42/4885KIF11 4857/4885
US-20230226074-A1 METHODS OF USE FOR PYRIMIDINES AS FERROPORTIN INHIBITORS SLC40A1, HAMP, SLC19A1 CNR1 3903/4885CNR2 4121/4885KIF11 4616/4885
US-20210009549-A1 CANNABINOID DERIVATIVES AND CONJUGATES AND USES THEREOF CNR1, GLRA1, GLRA3 CNR1 1/4885CNR2 4/4885KIF11 3424/4885
US-20230285573-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE NEDD4, CBL, UBQLN2 CNR1 3350/4885CNR2 3411/4885KIF11 3615/4885
US-20050148627-A1 Benzopyran compounds for use in the treatment and prevention of inflammation related conditions PTGES2, PTGER2, PTGES CNR1 95/4885CNR2 36/4885KIF11 4869/4885

“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.