SCHEMBL5406701

SCHEMBL5406701

Clc1ccccc1C1CC=CCC1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.49
TP53 P04637 1/20 0.46
RECQL P46063 1/20 0.46
OPRL1 P41146 2/20 0.39
ADRA1A P35348 2/20 0.39
ADRA1D P25100 1/20 0.37
ADRA1B P35368 1/20 0.37
HTR2A P28223 1/20 0.36
HTR2C P28335 1/20 0.36
HTR2B P41595 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.34
TAAR1 Q96RJ0 1/20 0.34
LDHA P00338 1/20 0.34
LDHB P07195 1/20 0.34
HCAR2 Q8TDS4 1/20 0.34
TRPV6 Q9H1D0 1/20 0.34
RIPK1 Q13546 1/20 0.34

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
SCHEMBL4065015 0.78 TP53 (0.50) DPP4TP53RECQLOPRL1ADRA1A
SCHEMBL29557462 0.77 HTR2C (0.52) HTR2AHTR2CHTR2BTAAR1
SCHEMBL21336326 0.77 CASP1 (0.33) DPP4SMN1; SMN2
SCHEMBL30217494 0.77 KDM1A (0.41) ADRA1AADRA1DADRA1BHTR2CHTR2B
SCHEMBL31053095 0.77 HTR2C (0.52) HTR2AHTR2CHTR2BTAAR1
SCHEMBL971145 0.77 KDM1A (0.40) HTR2AHTR2CHTR2BSMN1; SMN2
SCHEMBL10336974 0.77 RAB9A (0.41) RECQLHTR2AHTR2CHTR2BSMN1; SMN2
SCHEMBL1897406 0.77 TP53 (0.57) DPP4TP53RECQLOPRL1ADRA1A
Charcoal, Activated SCHEMBL5897477 0.74 TP53 (0.55) DPP4TP53RECQLOPRL1ADRA1A
SCHEMBL10740295 0.73 LMNA (0.40) DPP4SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1775276-B1 Process for the coupling of benzylamines and halogenated aromates SALTIGO GMBH (DE) 2012-08-29 EP claimed
EP-1775276-B1 Process for the coupling of benzylamines and halogenated aromates SALTIGO GMBH (DE) 2012-08-29 EP disclosed
US-7276630-B2 Process for coupling benzylamines with haloaromatics SALTIGO GMBH (DE) 2007-10-02 US disclosed
EP-1775276-A1 Process for the coupling of benzylamines and halogenated aromates Saltigo GmbH (DE) 2007-04-18 EP disclosed
CN-1939894-A Process for the coupling of benzylamines and halogenated aromates SALTIGO GMBH (DE) 2007-04-04 CN disclosed
US-20070073078-A1 Process for coupling benzylamines with haloaromatics SALTIGO GMBH (DE) 2007-03-29 US disclosed
CN-1278725-A Indeno [1,2-c]-naphtho [1,2-C]- and benzo [6,7] cyclohepta [1,2-C] pyrazole derivatives BASF AG (DE) 2001-01-03 CN 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 (1 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-20070073078-A1 Process for coupling benzylamines with haloaromatics BRD1, BRD2, BRD7 DPP4 2256/4885TP53 4365/4885RECQL 2970/4885

“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.