SCHEMBL6714356

SCHEMBL6714356

O=Cc1cc(Cl)ccc1-c1noc2ccccc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 5/20 0.50
ESR2 Q92731 5/20 0.50
ERN1 O75460 1/20 0.42
HIF1A Q16665 2/20 0.41
FFAR4 Q5NUL3 1/20 0.41
GAA P10253 1/20 0.41
XDH P47989 1/20 0.39
KAT6A Q92794 1/20 0.39
PTPN1 P18031 1/20 0.38
AHR P35869 1/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
TP53 P04637 2/20 0.38
ALOX15 P16050 1/20 0.38
TSHR P16473 1/20 0.38
KCNJ6 P48051 1/20 0.38
KCNJ3 P48549 1/20 0.38
HSP90AA1 P07900 2/20 0.38
LMNA P02545 1/20 0.38
RAB9A P51151 1/20 0.38
MAPT P10636 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
SCHEMBL7560387 0.88 ESR1 (0.43) ESR1ESR2ERN1XDHPTPN1
SCHEMBL26982053 0.83 ESR1 (0.50) ESR1ESR2ERN1FFAR4PTPN1
SCHEMBL6712825 0.83 ESR1 (0.50) ESR1ESR2HIF1AFFAR4PTPN1
SCHEMBL6711117 0.83 ESR1 (0.44) ESR1ESR2ERN1PTPN1AHR
SCHEMBL6711107 0.82 ESR1 (0.50) ESR1ESR2HIF1AFFAR4XDH
SCHEMBL6712729 0.80 ALDH1A1 (0.40) ESR1ESR2XDHPTPN1HSP90AA1
SCHEMBL26982289 0.80 ESR1 (0.47) ESR1ESR2ERN1HIF1APTPN1
SCHEMBL27443248 0.78 ESR1 (0.48) ESR1ESR2ERN1FFAR4PTPN1
SCHEMBL31256743 0.78 ESR1 (0.54) ESR1ESR2HIF1AFFAR4KAT6A
SCHEMBL5992116 0.76 ESR1 (0.59) ESR1ESR2HIF1AFFAR4GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040229910-A1 Therapeutic compounds N.V. ORGANON (NL) 2004-11-18 US disclosed
CN-1139580-C Substituted benzylamines and their use for the treatment of depression ��˹��ŵ�� 2004-02-25 CN disclosed
EP-0898566-B1 SUBSTITUTED BENZYLAMINES AND THEIR USE FOR THE TREATMENT OF DEPRESSION AKZO NOBEL NV (NL) 2002-11-06 EP disclosed
US-20020037885-A1 Therapeutic compounds DIJCKS FREDERICUS ANTONIUS (NL) 2002-03-28 US disclosed
US-6313139-B1 ADMINISTERING BENZYLAMINE DERIVATIVE FOR THERAPY OF PSYCHIATRIC DISORDER IN MAMMALS AKZO NOBEL N. V. (NL) 2001-11-06 US disclosed
US-6080773-A USEFUL FOR TREATMENT OF DEPRESSION, ANXIETY OR PSYCHOSIS AKZO NOBEL, N.V. (NL) 2000-06-27 US disclosed
CN-1219169-A Substituted benzylamines and their use for the treatment of depression AKZO NOBEL NV (NL) 1999-06-09 CN disclosed
EP-0898566-A1 SUBSTITUTED BENZYLAMINES AND THEIR USE FOR THE TREATMENT OF DEPRESSION Akzo Nobel N.V. (NL) 1999-03-03 EP disclosed
WO-1997040027-A1 SUBSTITUTED BENZYLAMINES AND THEIR USE FOR THE TREATMENT OF DEPRESSION AKZO NOBEL N.V. (NL) 1997-10-30 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 (2 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-20040229910-A1 Therapeutic compounds BDNF, PNMT, SLC18A2 ESR1 2865/4885ESR2 1589/4885ERN1 3739/4885
US-20020037885-A1 Therapeutic compounds BDNF, PNMT, SLC18A2 ESR1 2865/4885ESR2 1589/4885ERN1 3739/4885

“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.