SCHEMBL613009

SCHEMBL613009

NCC(c1ccccc1)c1cccc2ccccc12

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 1/20 0.58
HTR2A P28223 2/20 0.56
TAAR1 Q96RJ0 2/20 0.56
ALDH1A1 P00352 2/20 0.49
CYP1A2 P05177 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
CHRNB2 P17787 1/20 0.47
CHRNA4 P43681 1/20 0.47
HRH1 P35367 1/20 0.42
ACP3 P15309 1/20 0.41
AOC3 Q16853 1/20 0.41

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
SCHEMBL6006319 0.85 SLC6A4 (0.64) SLC6A4HTR2ATAAR1ALDH1A1CYP1A2
SCHEMBL12506240 0.82 SLC6A4 (0.65) SLC6A4HTR2AALDH1A1CYP1A2CYP2C9
SCHEMBL5010133 0.81 SLC6A4 (0.58) SLC6A4ALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL613299 0.79 CYP1A2 (0.47) SLC6A4ALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL16721029 0.78 SLC6A4 (0.64) SLC6A4ALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL5010699 0.78 SLC6A4 (0.64) SLC6A4ALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL11081859 0.78 SLC6A4 (0.69) SLC6A4ALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL3676939 0.78 SLC6A4 (0.59) SLC6A4TAAR1ALDH1A1CYP1A2CYP2C9
SCHEMBL4900483 0.78 SLC6A4 (0.59) SLC6A4TAAR1ALDH1A1CYP1A2CYP2C9
SCHEMBL3680320 0.78 SLC6A4 (0.59) SLC6A4TAAR1ALDH1A1CYP1A2CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2299275-B1 Classification of the oncofetal fibronection level for pregnancy-related indications ADEZA BIOMEDICAL CORP (US) 2018-03-07 EP disclosed
US-9513298-B2 Methods for detecting oncofetal fibronectin BANK OF AMERICA, N.A., AS COLLATERAL AGENT 2016-12-06 US disclosed
US-20150044708-A1 Methods for Detecting Oncofetal Fibronectin HOLOGIC, INC. 2015-02-12 US disclosed
US-8852872-B2 Methods for detecting oncofetal fibronectin HOLOGIC, INC. (US) 2014-10-07 US disclosed
US-20130171672-A1 Methods for Detecting Oncofetal Fibronectin HOLOGIC, INC. (US) 2013-07-04 US disclosed
US-8372581-B2 Methods for detecting oncofetal fibronectin CYTYC CORPORATION (US) 2013-02-12 US disclosed
US-20120040356-A1 Methods for Detecting Oncofetal Fibronectin CYTYC SURGICAL PRODUCTS, LIMITED PARTNERSHIP 2012-02-16 US disclosed
EP-1778874-B1 ONCOFETAL FIBRONECTIN AS A MARKER FOR CERVICAL CANCER ADEZA BIOMEDICAL CORP (US) 2011-11-23 EP disclosed
EP-2299275-A2 Classification of the oncofetal fibronection level for the indication of diseases and other conditions ADEZA BIOMEDICAL CORPORATION (US) 2011-03-23 EP disclosed
EP-2018364-A1 THERAPEUTIC FLUOROETHYL UREAS Allergan, Inc. (US) 2009-01-28 EP disclosed
WO-2007137029-A1 THERAPEUTIC FLUOROETHYL UREAS ALLERGAN, INC. (US) 2007-11-29 WO disclosed
EP-1778874-A2 ONCOFETAL FIBRONECTIN AS A MARKER FOR DISEASE AND OTHER CONDITIONS AND METHODS FOR DETECTION OF ONCOFETAL FIBRONECTIN ADEZA BIOMEDICAL CORPORATION (US) 2007-05-02 EP disclosed
WO-2006026020-A9 ONCOFETAL FIBRONECTIN AS A MARKER FOR DISEASE AND OTHER CONDITIONS AND METHODS FOR DETECTION OF ONCOFETAL FIBRONECTIN ADEZA BIOMEDICAL CORP (US) 2006-07-06 WO disclosed
WO-2006026020-A2 ONCOFETAL FIBRONECTIN AS A MARKER FOR DISEASE AND OTHER CONDITIONS AND METHODS FOR DETECTION OF ONCOFETAL FIBRONECTIN ADEZA BIOMEDICAL CORPORATION (US) 2006-03-09 WO disclosed
US-20060024724-A1 Oncofetal fibronectin as a marker for health and disease CYTYC SURGICAL PRODUCTS II LIMITED PARTNERSHIP 2006-02-02 US disclosed
US-20060024725-A1 Oncofetal fibronectin as a marker for pregnancy-related indications THIRD WAVE TECHNOLOGIES, INC. 2006-02-02 US disclosed
US-20060024757-A1 Detection of oncofetal fibronectin for selection of concepti CYTYC SURGICAL PRODUCTS II LIMITED PARTNERSHIP 2006-02-02 US disclosed
US-20060024722-A1 Samples for detection of oncofetal fibronectin and uses thereof BIOLUCENT, LLC 2006-02-02 US disclosed
US-20060024723-A1 Methods for detecting oncofetal fibronectin CYTYC SURGICAL PRODUCTS, LIMITED PARTNERSHIP 2006-02-02 US disclosed