SCHEMBL2103604

SCHEMBL2103604

O=C(c1ccc(-c2cc(Cl)ccc2O)cc1Cl)N1CCCC1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 2/20 0.50
KCNH2 Q12809 1/20 0.47
HRH3 Q9Y5N1 1/20 0.47
TSHR P16473 2/20 0.47
KDM4E B2RXH2 2/20 0.47
LMNA P02545 1/20 0.47
TP53 P04637 1/20 0.47
ALOX15 P16050 1/20 0.47
HPGD P15428 3/20 0.46
SPR P35270 2/20 0.46
USP2 O75604 1/20 0.46
CNR1 P21554 1/20 0.46
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
P2RX7 Q99572 1/20 0.45
POLB P06746 2/20 0.45
BRD9 Q9H8M2 2/20 0.45
HSD17B10 Q99714 1/20 0.44
MTOR P42345 1/20 0.44

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
SCHEMBL2102484 0.89 KDM4E (0.64) HSP90AA1TSHRKDM4ELMNATP53
SCHEMBL3525797 0.87 ABL1 (0.46) HSP90AA1TSHRKDM4ELMNATP53
SCHEMBL2099200 0.87 HPGD (0.47) HSP90AA1KCNH2HRH3TSHRKDM4E
SCHEMBL2103916 0.84 TMPRSS4 (0.43) HSP90AA1TSHRKDM4ELMNATP53
SCHEMBL24508969 0.83 P2RX7 (0.60) HSP90AA1TSHRKDM4ELMNATP53
SCHEMBL2102340 0.83 KMT2A (0.49) KCNH2HRH3TSHRKDM4ELMNA
SCHEMBL3529322 0.83 PIK3CA (0.44) TSHRKDM4ELMNATP53ALOX15
SCHEMBL487902 0.81 HSP90AA1 (0.63) HSP90AA1HRH3TSHRKDM4ELMNA
SCHEMBL29944105 0.81 MEN1 (0.62) HSP90AA1TSHRKDM4ELMNATP53
SCHEMBL11488934 0.81 MEN1 (0.62) HSP90AA1TSHRKDM4ELMNATP53

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
US-8722741-B2 Biphenyloxyacetic acid derivatives for the treatment of respiratory disease ASTRAZENECA AB (SE) 2014-05-13 US disclosed
EP-1784388-B3 BIPHENYLOXYACETIC ACID DERIVATIVES FOR THE TREATMENT OF RESPIRATORY DISEASE ASTRAZENECA AB (SE) 2012-09-05 EP disclosed
US-20120178732-A1 Biphenyloxyacetic Acid Derivatives for the Treatment of Respiratory Disease LUKER TIMOTHY JON (GB) 2012-07-12 US disclosed
US-8163727-B2 Biphenyloxyacetic acid derivatives for the treatment of respiratory disease ASTRAZENECA AB (SE) 2012-04-24 US disclosed
US-20100160285-A1 Biphenyloxyacetic Acid Derivatives for the Treatment of Respiratory Disease ASTRAZENECA AB (SE) 2010-06-24 US disclosed
US-7737135-B2 Biphenyloxyacetic acid derivatives for the treatment of respiratory disease ASTRAZENECA AB (SE) 2010-06-15 US disclosed
EP-1784388-B1 BIPHENYLOXYACETIC ACID DERIVATIVES FOR THE TREATMENT OF RESPIRATORY DISEASE ASTRAZENECA AB (SE) 2009-11-04 EP disclosed
US-20080132480-A1 Biphenyloxyacetic Acid Derivatives for the Treatment of Respiratory Disease ASTRAZENECA AB (SE) 2008-06-05 US disclosed
EP-1784388-A1 BIPHENYLOXYACETIC ACID DERIVATIVES FOR THE TREATMENT OF RESPIRATORY DISEASE AstraZeneca AB (SE) 2007-05-16 EP disclosed
WO-2006021759-A1 BIPHENYLOXYACETIC ACID DERIVATIVES FOR THE TREATMENT OF RESPIRATORY DISEASE ASTRAZENECA AB (SE) 2006-03-02 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 (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-20120178732-A1 Biphenyloxyacetic Acid Derivatives for the Treatment of Respiratory Disease CYP26A1, CYP1A1, GPBAR1 HSP90AA1 891/4885KCNH2 3213/4885HRH3 573/4885
US-20100160285-A1 Biphenyloxyacetic Acid Derivatives for the Treatment of Respiratory Disease CYP26A1, CYP1A1, GPBAR1 HSP90AA1 891/4885KCNH2 3213/4885HRH3 573/4885
US-20080132480-A1 Biphenyloxyacetic Acid Derivatives for the Treatment of Respiratory Disease CYP26A1, CYP1A1, GPBAR1 HSP90AA1 891/4885KCNH2 3213/4885HRH3 573/4885

“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.