SCHEMBL17030696

SCHEMBL17030696

CCN(CCCC(=O)NCCCCC(C(=O)O)N(C)CC(=O)O)c1cc(OC)c(-c2c3ccc(=N)cc-3oc3cc(N)ccc23)cc1C

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ABCB1 P08183 1/20 0.40
▸ USP2 O75604 1/20 0.39
▸ CFTR P13569 1/20 0.39
▸ PAX8 Q06710 1/20 0.39
▸ ATM Q13315 1/20 0.39
▸ GOPC Q9HD26 1/20 0.39
▸ ALB P02768 2/20 0.33
▸ FPR2 P25090 2/20 0.31
▸ FOLH1 Q04609 1/20 0.30

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
SCHEMBL17030726 0.96 ABCB1 (0.41) ABCB1USP2CFTRPAX8ATM
SCHEMBL17030822 0.90 ABCB1 (0.41) ABCB1USP2CFTRPAX8ATM
SCHEMBL17030704 0.86 ABCB1 (0.38) ABCB1USP2CFTRPAX8ATM
SCHEMBL16985191 0.86 HTR3A (0.39) FPR2
SCHEMBL17030680 0.84 ABCB1 (0.49) ABCB1USP2CFTRPAX8ATM
SCHEMBL17030694 0.82 ABCB1 (0.50) ABCB1USP2CFTRPAX8ATM
SCHEMBL17030689 0.82 ABCB1 (0.47) ABCB1USP2CFTRPAX8ATM
SCHEMBL16985206 0.81 HTR3A (0.40) FPR2
SCHEMBL17030823 0.81 ABCB1 (0.38) ABCB1USP2CFTRPAX8ATM
SCHEMBL18884170 0.81 FPR2 (0.33) ALBFPR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150241438-A1 Fluorogenic pH-Sensitive Dyes and Their Methods of Use Life Technologies Corporation 2015-08-27 — — 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 (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-20150241438-A1 Fluorogenic pH-Sensitive Dyes and Their Methods of Use ALPG, XDH, HEXD ABCB1 1030/4885USP2 3629/4885CFTR 2875/4885

“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