SCHEMBL1699581

SCHEMBL1699581

CC(=O)Cc1cccc(C)c1Cl

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.41
PTGS2 P35354 4/20 0.41
CLIC1 O00299 1/20 0.40
CXCL8 P10145 1/20 0.40
CLCN2 P51788 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
CTBP2 P56545 1/20 0.39
IAPP P10997 1/20 0.37
SLC22A12 Q96S37 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
PNMT P11086 1/20 0.36
CCR3 P51677 1/20 0.36
IDO1 P14902 1/20 0.36
P2RX7 Q99572 1/20 0.36
MAOB P27338 1/20 0.36

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
SCHEMBL30785266 1.00 L3MBTL1 (0.41) L3MBTL1PTGS2CLIC1CXCL8CLCN2
SCHEMBL27780154 0.85 PTGS2 (0.55) PTGS2CLIC1CXCL8CLCN2CTBP2
SCHEMBL8984622 0.84 PNMT (0.54) L3MBTL1PTGS2CXCL8SMN1; SMN2NPC1
SCHEMBL10749009 0.81 IAPP (0.54) L3MBTL1PTGS2CLIC1CXCL8CLCN2
SCHEMBL7188564 0.80 L3MBTL1 (0.43) L3MBTL1PTGS2SMN1; SMN2CTBP2IAPP
SCHEMBL782187 0.79 CTBP2 (0.56) L3MBTL1PTGS2SMN1; SMN2CTBP2NPC1
SCHEMBL30446395 0.79 CTBP2 (0.56) L3MBTL1PTGS2SMN1; SMN2CTBP2NPC1
SCHEMBL24173599 0.79 ANO1 (0.43) L3MBTL1PTGS2CXCL8SMN1; SMN2IAPP
SCHEMBL6367097 0.79 NLRP3 (0.48)
SCHEMBL5991730 0.78 ALDH1A1 (0.50) L3MBTL1PTGS2SMN1; SMN2CTBP2IAPP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2588450-B1 NAPHT-2-YLACETIC ACID DERIVATIVES TO TREAT AIDS GILEAD SCIENCES INC (US) 2017-05-24 EP disclosed
EP-2588450-B1 NAPHT-2-YLACETIC ACID DERIVATIVES TO TREAT AIDS GILEAD SCIENCES INC (US) 2017-05-24 EP disclosed
US-9102614-B2 Naphth-2-ylacetic acid derivatives to treat AIDS GILEAD SCIENCES, INC. (US) 2015-08-11 US disclosed
US-9102614-B2 Naphth-2-ylacetic acid derivatives to treat AIDS GILEAD SCIENCES, INC. (US) 2015-08-11 US disclosed
US-9102614-B2 Naphth-2-ylacetic acid derivatives to treat AIDS GILEAD SCIENCES, INC. (US) 2015-08-11 US disclosed
US-20130203727-A1 NAPHT-2-YLACETIC ACID DERIVATIVES TO TREAT AIDS GILEAD SCIENCES, INC. (US) 2013-08-08 US disclosed
US-20130203727-A1 NAPHT-2-YLACETIC ACID DERIVATIVES TO TREAT AIDS GILEAD SCIENCES, INC. (US) 2013-08-08 US disclosed
US-20130203727-A1 NAPHT-2-YLACETIC ACID DERIVATIVES TO TREAT AIDS GILEAD SCIENCES, INC. (US) 2013-08-08 US disclosed
EP-2588450-A1 NAPHT- 2 -YLACETIC ACID DERIVATIVES TO TREAT AIDS Gilead Sciences, Inc. (US) 2013-05-08 EP disclosed
WO-2012003497-A1 NAPHT- 2 -YLACETIC ACID DERIVATIVES TO TREAT AIDS GILEAD SCIENCES, INC. (US) 2012-01-05 WO disclosed
WO-2012003497-A1 NAPHT- 2 -YLACETIC ACID DERIVATIVES TO TREAT AIDS GILEAD SCIENCES, INC. (US) 2012-01-05 WO 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-20130203727-A1 NAPHT-2-YLACETIC ACID DERIVATIVES TO TREAT AIDS NFATC1, AADAT, ACAT1 L3MBTL1 4008/4885PTGS2 2187/4885CLIC1 422/4885

“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.