SCHEMBL16077702

SCHEMBL16077702

CCC(=O)N1CCC(CC2CCN(C(=O)CC)CC2)CC1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 12/20 0.51
▸ EPHX1 P07099 2/20 0.48
▸ ALDH1A1 P00352 2/20 0.45
▸ CHRNB2 P17787 2/20 0.44
▸ CHRNA3 P32297 2/20 0.44
▸ CHRNA4 P43681 2/20 0.44
▸ NPC1 O15118 1/20 0.44
▸ CHRNB3 Q05901 1/20 0.44
▸ CHRNA6 Q15825 1/20 0.44
▸ GNAI3 P08754 1/20 0.42
▸ GNAO1 P09471 1/20 0.42
▸ GNAI1 P63096 1/20 0.42
▸ CHRNB4 P30926 1/20 0.42
▸ CHRNA7 P36544 1/20 0.42
▸ BLM P54132 1/20 0.42

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
SCHEMBL26263454 0.92 GNAI3 (0.53) EPHX2EPHX1ALDH1A1CHRNB2CHRNA3
SCHEMBL24501935 0.88 EPHX2 (0.43) EPHX2EPHX1ALDH1A1GNAI3GNAO1
SCHEMBL4487574 0.87 EPHX2 (0.51) EPHX2EPHX1ALDH1A1CHRNB2CHRNA3
SCHEMBL621450 0.85 EPHX2 (0.50) EPHX2EPHX1ALDH1A1CHRNB2CHRNA3
SCHEMBL4578708 0.85 EPHX2 (0.50) EPHX2EPHX1ALDH1A1CHRNB2CHRNA3
SCHEMBL4518519 0.83 GNAI3 (0.51) EPHX2EPHX1ALDH1A1CHRNB2CHRNA3
SCHEMBL10305557 0.83 EPHX2 (0.49) EPHX2EPHX1ALDH1A1
SCHEMBL6029465 0.83 EPHX2 (0.49) EPHX2EPHX1ALDH1A1CHRNB2CHRNA3
SCHEMBL3317695 0.83 EPHX2 (0.49) EPHX2EPHX1ALDH1A1CHRNB2CHRNA3
SCHEMBL15128614 0.82 EPHX2 (0.43) EPHX2EPHX1ALDH1A1CHRNB2CHRNA3

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 EPHX2 3584/4885EPHX1 4025/4885ALDH1A1 4279/4885
US-20140275469-A1 AMINE FUNCTIONAL POLYAMIDES PAM, ASNS, PARN EPHX2 3584/4885EPHX1 4025/4885ALDH1A1 4279/4885

“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.

Send feedback