SCHEMBL470342

SCHEMBL470342

O=C(Cl)c1ccc(N2CCCOC2=O)cc1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
F10 P00742 2/20 0.47
KDM1A O60341 7/20 0.45
MAOA P21397 2/20 0.45
MAOB P27338 2/20 0.45
RCOR1 Q9UKL0 2/20 0.45
ALDH1A1 P00352 3/20 0.44
HPGD P15428 3/20 0.43
CMA1 P23946 2/20 0.42
TNKS O95271 1/20 0.40
MAPT P10636 1/20 0.38
BCL2 P10415 1/20 0.36
BECN1 Q14457 1/20 0.36

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
SCHEMBL458678 0.90 KDM1A (0.53) F10KDM1AMAOAMAOBRCOR1
SCHEMBL5427100 0.86 ALDH1A1 (0.61) F10KDM1AMAOAMAOBRCOR1
SCHEMBL4414346 0.78 DDB1 (0.43) F10KDM1AMAOAMAOBRCOR1
SCHEMBL25235536 0.77 HTT (0.51) MAOAALDH1A1HPGDCMA1MAPT
SCHEMBL15628295 0.77 TNKS (0.40) F10KDM1AMAOAMAOBRCOR1
SCHEMBL29348768 0.77 BCL2 (0.41) F10KDM1ACMA1TNKSBCL2
SCHEMBL8303458 0.77 DGAT1 (0.43) F10KDM1ACMA1TNKS
SCHEMBL991958 0.76 MEN1 (0.50) KDM1ACMA1TNKSMAPT
SCHEMBL457785 0.76 ALDH1A1 (0.75) ALDH1A1HPGDMAPT
SCHEMBL1019042 0.76 ALDH1A1 (0.56) F10KDM1AMAOAMAOBRCOR1

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
EP-2614052-B1 NOVEL PIPERAZINE ANALOGS AS BROAD-SPECTRUM INFLUENZA ANTIVIRALS BRISTOL MYERS SQUIBB CO (US) 2014-12-31 EP disclosed
EP-2614052-B1 NOVEL PIPERAZINE ANALOGS AS BROAD-SPECTRUM INFLUENZA ANTIVIRALS BRISTOL MYERS SQUIBB CO (US) 2014-12-31 EP disclosed
US-8362004-B2 Piperazine analogs as broad-spectrum influenza antivirals BRISTOL-MYERS SQUIBB COMPANY (US) 2013-01-29 US disclosed
US-8362004-B2 Piperazine analogs as broad-spectrum influenza antivirals BRISTOL-MYERS SQUIBB COMPANY (US) 2013-01-29 US disclosed
US-8362004-B2 Piperazine analogs as broad-spectrum influenza antivirals BRISTOL-MYERS SQUIBB COMPANY (US) 2013-01-29 US disclosed
US-20120238539-A1 NOVEL PIPERAZINE ANALOGS AS BROAD-SPECTRUM INFLUENZA ANTIVIRALS BRISTOL-MYERS SQUIBB COMPANY 2012-09-20 US disclosed
US-20120238539-A1 NOVEL PIPERAZINE ANALOGS AS BROAD-SPECTRUM INFLUENZA ANTIVIRALS BRISTOL-MYERS SQUIBB COMPANY 2012-09-20 US disclosed
US-20120238539-A1 NOVEL PIPERAZINE ANALOGS AS BROAD-SPECTRUM INFLUENZA ANTIVIRALS BRISTOL-MYERS SQUIBB COMPANY 2012-09-20 US disclosed
WO-2012033736-A1 NOVEL PIPERAZINE ANALOGS AS BROAD-SPECTRUM INFLUENZA ANTIVIRALS BRISTOL-MYERS SQUIBB COMPANY (US) 2012-03-15 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 (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-20120238539-A1 NOVEL PIPERAZINE ANALOGS AS BROAD-SPECTRUM INFLUENZA ANTIVIRALS ZC3HAV1, ZC3HAV1L, HCRTR1 F10 3359/4885KDM1A 866/4885MAOA 1155/4885

“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.