Sugi Predict

Sugi Predict / Compounds / SCHEMBL1714570

SCHEMBL1714570

SCHEMBL1714570

CC1Nc2ccc3c(S(=O)(=O)O)cc(S(=O)(=O)O)cc3c2C1(C)CCCCCC(=O)O

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ FOLH1 Q04609 3/20 0.36
▸ MEN1 O00255 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ TBXA2R P21731 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ FABP4 P15090 2/20 0.31
▸ PKM P14618 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
SCHEMBL1714853 0.87 CASP6 (0.35) MEN1POLBKMT2ATDP1TBXA2R
SCHEMBL14695177 0.86 FOLH1 (0.31) FOLH1
SCHEMBL1714566 0.77 FOLH1 (0.36) FOLH1TBXA2RALDH1A1FABP4PKM
SCHEMBL10077596 0.73 FOLH1 (0.51) FOLH1TBXA2RALDH1A1FABP4PKM
SCHEMBL14695767 0.73 FOLH1 (0.40) FOLH1TBXA2RALDH1A1FABP4PKM
SCHEMBL10090494 0.72 FOLH1 (0.43) FOLH1
SCHEMBL31278367 0.71 FOLH1 (0.43) FOLH1TBXA2RALDH1A1FABP4PKM
SCHEMBL18288189 0.70 GAA (0.39) MEN1KMT2ATDP1TBXA2RALDH1A1
SCHEMBL716120 0.69 FOLH1 (0.47) FOLH1TBXA2RALDH1A1FABP4PKM
SCHEMBL5004279 0.69 FOLH1 (0.31) FOLH1

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-20150268246-A1 LUMINESCENT COMPOUNDS SETA BIOMEDICALS, LLC 2015-09-24 — — US disclosed
US-8044203-B2 Chiral indole intermediates and their fluorescent cyanine dyes containing functional groups CARNEGIE MELLON UNIVERSITY (US) 2011-10-25 — — US disclosed
EP-1525265-B1 CHIRAL INDOLE INTERMEDIATES AND THEIR FLUORESCENT CYANINE DYES CONTAINING FUNCTIONAL GROUPS UNIV CARNEGIE MELLON (US) 2011-07-20 — — EP disclosed
US-20100267008-A1 CHIRAL INDOLE INTERMEDIATES AND THEIR FLUORESCENT CYANINE DYES CONTAINING FUNCTIONAL GROUPS CARNEGIE MELLON UNIVERSITY (US) 2010-10-21 — — US disclosed
US-7615646-B2 Chiral indole intermediates and their fluorescent cyanine dyes containing functional groups CARNEGIE MELLON UNIVERSITY (US) 2009-11-10 — — US disclosed
US-20080076188-A1 Luminescent compounds SETA BIOMEDICALS, LLC 2008-03-27 — — US disclosed
US-20060051758-A1 Chiral indole intermediates and their fluorescent cyanine dyes containing functional groups NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2006-03-09 — — 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 (3 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-20060051758-A1 Chiral indole intermediates and their fluorescent cyanine dyes containing functional groups IDO1, TDO2, IDO2 FOLH1 4593/4885MEN1 3227/4885POLB 4597/4885
US-20100267008-A1 CHIRAL INDOLE INTERMEDIATES AND THEIR FLUORESCENT CYANINE DYES CONTAINING FUNCTIONAL GROUPS IDO1, IDO2, INMT FOLH1 4440/4885MEN1 1716/4885POLB 4567/4885
US-20080076188-A1 Luminescent compounds REL, QRFPR, RCOR3 FOLH1 3522/4885MEN1 3074/4885POLB 2187/4885

“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.