SCHEMBL1283564

SCHEMBL1283564

CCCCn1c(-c2ccc(OCCc3ccc(Cl)cc3)cc2)nc2c(CCCN(CC)CC)cc(OCCCN(CC)CC)cc21

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 10/20 0.50
DRD2 P14416 9/20 0.50
AGER Q15109 8/20 0.46
ATP4A P20648 1/20 0.42
ATP4B P51164 1/20 0.42
MAPT P10636 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
SCHEMBL1284125 0.91 DRD3 (0.51) DRD3DRD2AGERATP4AATP4B
SCHEMBL1283414 0.91 DRD3 (0.51) DRD3DRD2AGERATP4AATP4B
SCHEMBL1283544 0.91 DRD3 (0.51) DRD3DRD2AGERATP4AATP4B
SCHEMBL1615402 0.89 DRD3 (0.49) DRD3DRD2AGERATP4AATP4B
SCHEMBL1283117 0.87 DRD3 (0.47) DRD3DRD2AGERATP4AATP4B
SCHEMBL1284042 0.87 DRD2 (0.47) DRD3DRD2AGERATP4AATP4B
SCHEMBL1283284 0.86 DRD3 (0.60) DRD3DRD2AGERATP4AATP4B
SCHEMBL1282630 0.85 DRD3 (0.49) DRD3DRD2AGERATP4AATP4B
SCHEMBL1283600 0.85 DRD2 (0.44) DRD3DRD2AGERATP4AATP4B
SCHEMBL1614191 0.85 DRD3 (0.48) DRD3DRD2AGER

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
US-20120088778-A1 AZOLE DERIVATIVES AND FUSED BICYCLIC AZOLE DERIVATIVES AS THERAPEUTIC AGENTS TRANSTECH PHARMA, INC. (US) 2012-04-12 US disclosed
US-20100256119-A1 Azole derivatives and fused bicyclic azole derivatives as therapeutic agents TRANSTECH PHARMA, INC. 2010-10-07 US disclosed
US-7737285-B2 Azole derivatives and fused bicyclic azole derivatives as therapeutic agents TRANSTECH PHARMA, INC. (US) 2010-06-15 US disclosed
US-7714013-B2 Azole derivatives and fused bicyclic azole derivatives as therapeutic agents TRANSTECH PHARMA, INC. (US) 2010-05-11 US disclosed
US-7361678-B2 Azole derivatives and fused bicyclic azole derivatives as therapeutic agents TRANSTECH PHARMA, INC. (US) 2008-04-22 US disclosed
US-20070213347-A1 Azole derivatives and fused bicyclic azole derivatives as therapeutic agents TRANSTECH PHARMA (US) 2007-09-13 US disclosed
US-20070021386-A1 Azole derivatives and fused bicyclic azole derivatives as therapeutic agents TRANSTECH PHARMA (US) 2007-01-25 US 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 (4 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-20100256119-A1 Azole derivatives and fused bicyclic azole derivatives as therapeutic agents AGER, S100A4, S100B DRD3 4032/4885DRD2 4530/4885AGER 1/4885
US-20070021386-A1 Azole derivatives and fused bicyclic azole derivatives as therapeutic agents AGER, S100A4, S100B DRD3 4321/4885DRD2 4691/4885AGER 1/4885
US-20120088778-A1 AZOLE DERIVATIVES AND FUSED BICYCLIC AZOLE DERIVATIVES AS THERAPEUTIC AGENTS AGER, S100A4, S100B DRD3 4321/4885DRD2 4691/4885AGER 1/4885
US-20070213347-A1 Azole derivatives and fused bicyclic azole derivatives as therapeutic agents AGER, S100A4, S100B DRD3 4321/4885DRD2 4691/4885AGER 1/4885

“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.