SCHEMBL3987254

SCHEMBL3987254

CCOc1ccc(CCC2(C3CCCC3)CC(=O)CC(=O)O2)cc1Cl

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.34
SMN1; SMN2 Q16637 4/20 0.34
ALDH1A1 P00352 1/20 0.34
TP53 P04637 1/20 0.34
CREBBP Q92793 1/20 0.34
TSHR P16473 1/20 0.34
GLA P06280 1/20 0.33
P2RX3 P56373 2/20 0.33
USP2 O75604 1/20 0.33
MAPT P10636 1/20 0.33
POLB P06746 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
CSNK2A1 P68400 1/20 0.32
PPARA Q07869 1/20 0.32

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
SCHEMBL3985509 0.90 MEN1 (0.36) LMNASMN1; SMN2ALDH1A1TP53MAPT
SCHEMBL3986080 0.89 HPGD (0.41) P2RX3
SCHEMBL3988462 0.89 POLB (0.35) LMNASMN1; SMN2ALDH1A1TP53TSHR
SCHEMBL3989150 0.88 SLC5A2 (0.35) LMNASMN1; SMN2ALDH1A1TSHRMAPT
SCHEMBL13938934 0.88 TDP1 (0.42) LMNASMN1; SMN2TSHRMEN1KMT2A
SCHEMBL3988598 0.88 CSNK2A1 (0.31) P2RX3CSNK2A1
SCHEMBL3987162 0.88 HTR2A (0.36) CSNK2A1PPARA
SCHEMBL3988003 0.87 CSNK2A1 (0.40) LMNATP53P2RX3MEN1KMT2A
SCHEMBL3991024 0.87 KDM4E (0.31) ALDH1A1MEN1KMT2A
SCHEMBL3988007 0.85 HCRTR1 (0.35) LMNAALDH1A1TSHRP2RX3MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7473790-B2 Inhibitors of hepatitis C virus RNA-dependent RNA polymerase, and compositions and treatments using the same PFIZER INC. (US) 2009-01-06 US disclosed
US-7473790-B2 Inhibitors of hepatitis C virus RNA-dependent RNA polymerase, and compositions and treatments using the same PFIZER INC. (US) 2009-01-06 US disclosed
US-7473790-B2 Inhibitors of hepatitis C virus RNA-dependent RNA polymerase, and compositions and treatments using the same PFIZER INC. (US) 2009-01-06 US disclosed
US-7148226-B2 Inhibitors of hepatitis C virus RNA-dependent RNA polymerase, and compositions and treatments using the same AGOURON PHARMACEUTICALS, INC. (US) 2006-12-12 US disclosed
US-20060189681-A1 INHIBITORS OF HEPATITIS C VIRUS RNA-DEPENDENT RNA POLYMERASE, AND COMPOSITIONS AND TREATMENTS USING THE SAME AGOURON PHARMACEUTICALS, INC. 2006-08-24 US disclosed
EP-1597246-A2 INHIBITORS OF HEPATITIS C VIRUS RNA-DEPENDENT RNA POLYMERASE, AND COMPOSITIONS AND TREATMENTS USING THE SAME PFIZER INC. (US) 2005-11-23 EP disclosed
US-20050176701-A1 Inhibitors of hepatitis C virus RNA-dependent RNA polymerase, and compositions and treatments using the same AGOURON PHARMACEUTICALS, INC. 2005-08-11 US disclosed
WO-2004074270-A2 INHIBITORS OF HEPATITIS C VIRUS RNA-DEPENDENT RNA POLYMERASE, AND COMPOSITIONS AND TREATMENTS USING THE SAME PFIZER INC. (US) 2004-09-02 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 (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-20060189681-A1 INHIBITORS OF HEPATITIS C VIRUS RNA-DEPENDENT RNA POLYMERASE, AND COMPOSITIONS AND TREATMENTS USING THE SAME RNASE1, RNASEH1, NSUN3 LMNA 1494/4885SMN1; SMN2 3095/4885ALDH1A1 322/4885
US-20050176701-A1 Inhibitors of hepatitis C virus RNA-dependent RNA polymerase, and compositions and treatments using the same RNASE1, RNASEH1, NSUN3 LMNA 1494/4885SMN1; SMN2 3095/4885ALDH1A1 322/4885

“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.