SCHEMBL10192012

SCHEMBL10192012

Cc1cccc(NC(=O)OCCCCl)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 5/20 0.56
RAB9A P51151 5/20 0.56
LMNA P02545 3/20 0.56
NPC1 O15118 4/20 0.55
SMN1; SMN2 Q16637 3/20 0.55
CYP1A2 P05177 2/20 0.55
CYP2C9 P11712 2/20 0.55
CYP2C19 P33261 2/20 0.55
HSD17B10 Q99714 2/20 0.51
MAPK1 P28482 3/20 0.51
FAAH O00519 1/20 0.51
ALDH1A1 P00352 1/20 0.51
CYP3A4 P08684 1/20 0.51
EPHX2 P34913 1/20 0.51
ALOX15 P16050 1/20 0.51
TSHR P16473 1/20 0.51
HTT P42858 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50

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
SCHEMBL10192104 0.91 HSD17B10 (0.54) HPGDRAB9ALMNANPC1SMN1; SMN2
SCHEMBL10192011 0.87 RAB9A (0.72) HPGDRAB9ALMNANPC1SMN1; SMN2
SCHEMBL10192053 0.85 HSD17B10 (0.57) HPGDRAB9ALMNANPC1SMN1; SMN2
SCHEMBL11422530 0.84 RAB9A (0.53) HPGDRAB9ALMNANPC1SMN1; SMN2
SCHEMBL22261982 0.84 MEN1 (0.69) HPGDRAB9ALMNANPC1SMN1; SMN2
SCHEMBL10191988 0.84 HPGD (0.71) HPGDRAB9ALMNANPC1SMN1; SMN2
SCHEMBL8211088 0.82 MAPK1 (0.57) HPGDRAB9ALMNANPC1SMN1; SMN2
SCHEMBL10192006 0.82 HSD17B10 (0.54) HPGDRAB9ALMNANPC1SMN1; SMN2
SCHEMBL10192025 0.82 SMN1; SMN2 (0.52) HPGDRAB9ALMNANPC1SMN1; SMN2
SCHEMBL7980860 0.82 NPC1 (0.62) HPGDRAB9ALMNANPC1SMN1; SMN2

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-20120009142-A1 METHODS FOR TREATING HEPATITIS C PTC THERAPEUTICS, INC. (US) 2012-01-12 US disclosed
US-20110268698-A1 METHODS FOR TREATING HEPATITIS C PTC THERAPEUTICS, INC. (US) 2011-11-03 US disclosed
US-8013006-B2 Methods for treating hepatitis C PTC THERAPEUTICS, INC. (US) 2011-09-06 US disclosed
US-7973069-B2 Methods for treating hepatitis C PTC THERAPEUTICS, INC. (US) 2011-07-05 US disclosed
US-20100305100-A1 METHODS FOR TREATING HEPATITIS C PTC THERAPEUTICS, INC. (US) 2010-12-02 US disclosed
US-20100292187-A1 METHODS FOR TREATING HEPATITIS C PTC THERAPEUTICS, INC. (US) 2010-11-18 US disclosed
US-20080096928-A9 Indole compounds that modify translational control of Hepatitis C virus PTC THERAPEUTICS, INC. 2008-04-24 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 (5 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-20080096928-A9 Indole compounds that modify translational control of Hepatitis C virus EIF2AK2, INMT, IDO1 HPGD 3067/4885RAB9A 3470/4885LMNA 4373/4885
US-20110268698-A1 METHODS FOR TREATING HEPATITIS C HAVCR2, LIPC, HCCS HPGD 1342/4885RAB9A 3241/4885LMNA 1241/4885
US-20120009142-A1 METHODS FOR TREATING HEPATITIS C OAT, HAVCR2, HCCS HPGD 1033/4885RAB9A 3975/4885LMNA 3101/4885
US-20100292187-A1 METHODS FOR TREATING HEPATITIS C HAVCR2, EIF2AK2, MAVS HPGD 3255/4885RAB9A 2829/4885LMNA 1012/4885
US-20100305100-A1 METHODS FOR TREATING HEPATITIS C HAVCR2, EIF2AK2, MAVS HPGD 3255/4885RAB9A 2829/4885LMNA 1012/4885

“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.