SCHEMBL16077705

SCHEMBL16077705

CCCCNC(=O)CCN1CCC(C2CCN(CCC(=O)NC)CC2)CC1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GNAI3 P08754 6/20 0.43
GNAO1 P09471 6/20 0.43
GNAI1 P63096 6/20 0.43
OPRD1 P41143 1/20 0.43
POLB P06746 1/20 0.42
HTT P42858 1/20 0.42
CASP2 P42575 1/20 0.41
ALDH1A1 P00352 3/20 0.40
TDP1 Q9NUW8 1/20 0.40
MAPT P10636 1/20 0.40
NAAA Q02083 1/20 0.40
PLD1 Q13393 2/20 0.39
TP53 P04637 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
KDM4E B2RXH2 1/20 0.39
NPC1 O15118 1/20 0.39
GAA P10253 1/20 0.39

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
SCHEMBL16077707 0.96 GNAI3 (0.48) GNAI3GNAO1GNAI1OPRD1POLB
SCHEMBL16076285 0.95 OPRD1 (0.42) GNAI3GNAO1GNAI1OPRD1POLB
SCHEMBL16077706 0.92 POLB (0.48) GNAI3GNAO1GNAI1OPRD1POLB
SCHEMBL16076286 0.89 USP2 (0.43) GNAI3GNAO1GNAI1OPRD1POLB
SCHEMBL16122917 0.88 ALDH1A1 (0.46) GNAI3GNAO1GNAI1OPRD1POLB
SCHEMBL16076284 0.83 POLB (0.38) GNAI3GNAO1GNAI1POLBHTT
SCHEMBL16079041 0.82 SIGMAR1 (0.48) GNAI3GNAO1GNAI1OPRD1POLB
SCHEMBL5956990 0.80 SMN1; SMN2 (0.54) OPRD1HTTCASP2ALDH1A1TDP1
SCHEMBL24412614 0.79 POLB (0.57) GNAI3GNAO1GNAI1OPRD1POLB
SCHEMBL19487702 0.79 ALDH1A1 (0.43) GNAI3GNAO1GNAI1OPRD1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160208046-A1 AMINE FUNCTIONAL POLYAMIDES GENZYME CORPORATION 2016-07-21 US disclosed
US-9326994-B2 Amine functional polyamides GENZYME CORPORATION (US) 2016-05-03 US disclosed
US-20140275469-A1 AMINE FUNCTIONAL POLYAMIDES GENZYME CORPORATION (US) 2014-09-18 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-20160208046-A1 AMINE FUNCTIONAL POLYAMIDES PAM, ASNS, PARN GNAI3 3042/4885GNAO1 2569/4885GNAI1 2420/4885
US-20140275469-A1 AMINE FUNCTIONAL POLYAMIDES PAM, ASNS, PARN GNAI3 3042/4885GNAO1 2569/4885GNAI1 2420/4885

“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.