SCHEMBL6348778

SCHEMBL6348778

NCCCc1ccc2c(c1)CCC2

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TPSAB1 Q15661 1/20 0.43
RAD52 P43351 1/20 0.41
KMT2A Q03164 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
CYP1A2 P05177 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C19 P33261 1/20 0.40
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA7 P43166 1/20 0.39
CA14 Q9ULX7 1/20 0.39
RXRB P28702 2/20 0.39
KIF11 P52732 1/20 0.39
ADRA2A P08913 1/20 0.38
ADRA2B P18089 1/20 0.38
ADRA2C P18825 1/20 0.38
MPO P05164 1/20 0.38
RXRA P19793 1/20 0.37
RXRG P48443 1/20 0.37

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
SCHEMBL28297053 0.94 MAOA (0.44) TPSAB1RAD52KMT2ARXFP1CA12
SCHEMBL17188629 0.92 CYP2D6 (0.42) CYP1A2CYP2D6CYP2C19KIF11ADRA2A
SCHEMBL7796025 0.91 HRH1 (0.44) TPSAB1KIF11MAOA
SCHEMBL30496717 0.88 TAAR1 (0.45) CYP1A2CYP2D6CYP2C19CA12CA1
SCHEMBL5079011 0.88 TAAR1 (0.45) CYP1A2CYP2D6CYP2C19CA12CA1
Hydrochloric Acid SCHEMBL20563976 0.86 TDP1 (0.47) RAD52KMT2ARXFP1CYP2D6CA12
SCHEMBL30496730 0.86 TAAR1 (0.47) CYP1A2CYP2D6CYP2C19KIF11ADRA2A
SCHEMBL17186185 0.86 TAAR1 (0.47) CYP1A2CYP2D6CYP2C19KIF11ADRA2A
Hydrochloric Acid SCHEMBL5157753 0.84 TDP1 (0.48) KMT2ACYP1A2CYP2D6KIF11ADRA2A
SCHEMBL9720050 0.81 TSHR (0.46) CYP1A2CYP2C19RXRBADRA2AADRA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1243723-C N-phenylpropylcyclopentyl substituted glutaramide derivatives as NEP inhibitors of FSAD PFIZER LTD (US) 2006-03-01 CN disclosed
US-6849649-B2 N-phenpropylcyclopentyl-substituted glutaramide derivatives as inhibitors of neutral endopeptidase PFIZER INC. (US) 2005-02-01 US disclosed
US-20040106611-A1 N-phenpropylcyclopentyl-substituted glutaramide derivatives as inhibitors of neutral endopeptidase PFIZER INC 2004-06-03 US disclosed
CN-1492852-A N-phenylpropylcyclopentyl substituted glutaramide derivatives as NEP inhibitors of FSAD ������ҩ�����޹�˾ 2004-04-28 CN disclosed
US-6660756-B2 N-phenpropylcyclopentyl-substituted glutaramide derivatives as inhibitors of neutral endopeptidase PFIZER INC. 2003-12-09 US disclosed
US-20030105132-A1 N-phenpropylcuclopentyl-substituted glutaramide derivatives as inhibitors of neutral endopeptidase PFIZER INC. 2003-06-05 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 (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-20030105132-A1 N-phenpropylcuclopentyl-substituted glutaramide derivatives as inhibitors of neutral endopeptidase PREP, ENGASE, ENPEP TPSAB1 160/4885RAD52 3432/4885KMT2A 2144/4885
US-20040106611-A1 N-phenpropylcyclopentyl-substituted glutaramide derivatives as inhibitors of neutral endopeptidase PREP, ENGASE, ENPEP TPSAB1 84/4885RAD52 3451/4885KMT2A 2292/4885

“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.