SCHEMBL1973276

SCHEMBL1973276

CCCCOC(=O)c1nc(C)c2cc(-c3ccc(F)cc3)sc2c1O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.43
KDM4E B2RXH2 3/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
TRPM8 Q7Z2W7 2/20 0.40
ESR1 P03372 6/20 0.39
POLB P06746 2/20 0.38
HTR7 P34969 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.36
ALDH1A1 P00352 1/20 0.36
ATM Q13315 1/20 0.36
MEN1 O00255 1/20 0.36
HPGD P15428 1/20 0.36
KMT2A Q03164 1/20 0.36
IKBKB O14920 1/20 0.35
GABRA2 P47869 1/20 0.35
GABRB2 P47870 1/20 0.35
MAPK14 Q16539 1/20 0.35
GLA P06280 1/20 0.35

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
SCHEMBL1974064 0.92 MAPT (0.43) MAPTKDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL1972719 0.91 TRPM8 (0.41) MAPTKDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL1974058 0.89 ESR1 (0.40) MAPTKDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL1976686 0.87 SCN9A (0.42) MAPTKDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL1976981 0.87 TRPM8 (0.41) MAPTKDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL1973531 0.85 ESR1 (0.40) MAPTKDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL1973428 0.83 SMN1; SMN2 (0.41) MAPTKDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL1974984 0.82 ESR1 (0.46) KDM4ENPC1RAB9ASMN1; SMN2ESR1
SCHEMBL1975336 0.81 KDM4E (0.43) MAPTKDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL1978256 0.81 MAPT (0.48) MAPTKDM4ENPC1RAB9ASMN1; 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-9000006-B2 Thienopyridine compounds, and methods of use thereof FIBROGEN, INC. (US) 2015-04-07 US disclosed
US-20140221422-A1 NOVEL THIENOPYRIDINE COMPOUNDS, AND METHODS OF USE THEREOF FIBROGEN, INC. (US) 2014-08-07 US disclosed
US-8703795-B2 Thienopyridine compounds, and methods of use thereof FIBROGEN, INC. (US) 2014-04-22 US disclosed
EP-1866318-B1 THIENOPYRIDINE COMPOUNDS, AND METHODS OF USE THEREOF FIBROGEN INC (US) 2011-06-22 EP disclosed
EP-1866318-A2 THIENOPYRIDINE COMPOUNDS, AND METHODS OF USE THEREOF FIBROGEN, INC. (US) 2007-12-19 EP disclosed
WO-2006094292-A2 THIENOPYRIDINE COMPOUNDS, AND METHODS OF USE THEREOF FIBROGEN, INC. (US) 2006-09-08 WO disclosed
US-20060199836-A1 Novel thienopyridine compounds, and methods of use thereof FIBROGEN, INC. 2006-09-07 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 (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-20140221422-A1 NOVEL THIENOPYRIDINE COMPOUNDS, AND METHODS OF USE THEREOF HIF1AN, HIF1A, EGLN2 MAPT 3256/4885KDM4E 679/4885NPC1 4098/4885
US-20060199836-A1 Novel thienopyridine compounds, and methods of use thereof HIF1AN, HIF1A, EGLN2 MAPT 3256/4885KDM4E 679/4885NPC1 4098/4885

“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.