SCHEMBL13384111

SCHEMBL13384111

CCC1=CC(O)C(C)C(C)C1O

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL18879244 1.00
SCHEMBL18879133 0.82
SCHEMBL20126416 0.82
SCHEMBL18879238 0.78
SCHEMBL18879134 0.78
SCHEMBL14338120 0.74
SCHEMBL13384064 0.74
SCHEMBL15291826 0.74
SCHEMBL18879253 0.71
SCHEMBL13384184 0.69 GBA1 (0.36)

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
EP-2682746-B1 Methods for the diagnosis of ovarian cancer health states and risk of ovarian cancer health states PHENOMENOME DISCOVERIES INC (CA) 2017-05-24 EP disclosed
US-20160377623-A1 METHODS FOR THE DIAGNOSIS OF OVARIAN CANCER HEALTH STATES AND RISK OF OVARIAN CANCER HEALTH STATES MED-LIFE DISCOVERIES LP (CA) 2016-12-29 US disclosed
US-20160305928-A1 METHODS FOR THE DIAGNOSIS OF OVARIAN CANCER HEALTH STATES AND RISK OF OVARIAN CANCER HEALTH STATES MED-LIFE DISCOVERIES LP (CA) 2016-10-20 US disclosed
EP-2644588-A2 Biomarkers for diagnosing multiple sclerosis, and methods thereof Phenomenome Discoveries Inc. (CA) 2013-10-02 EP disclosed
US-20100086960-A1 METHODS FOR THE DIAGNOSIS OF OVARIAN CANCER HEALTH STATES AND RISK OF OVARIAN CANCER HEALTH STATES PHENOMENOME DISCOVERIES INC. (CA) 2010-04-08 US disclosed
US-20100086960-A1 METHODS FOR THE DIAGNOSIS OF OVARIAN CANCER HEALTH STATES AND RISK OF OVARIAN CANCER HEALTH STATES PHENOMENOME DISCOVERIES INC. (CA) 2010-04-08 US disclosed
US-20100062472-A1 BIOMARKERS FOR DIAGNOSING MULTIPLE SCLEROSIS, AND METHODS THEREOF PHENOMENOME DISCOVERIES INC. (CA) 2010-03-11 US disclosed
US-20100062472-A1 BIOMARKERS FOR DIAGNOSING MULTIPLE SCLEROSIS, AND METHODS THEREOF PHENOMENOME DISCOVERIES INC. (CA) 2010-03-11 US disclosed
WO-2008092280-A1 METHODS FOR THE DIAGNOSIS OF OVARIAN CANCER HEALTH STATES AND RISK OF OVARIAN CANCER HEALTH STATES PHENOMENOME DISCOVERIES INC. (CA) 2008-08-07 WO disclosed
WO-2007137410-A1 BIOMARKERS FOR DIAGNOSING MULTIPLE SCLEROSIS, AND METHODS THEREOF PHENOMENOME DISCOVERIES INC. (CA) 2007-12-06 WO disclosed