SCHEMBL8154199

SCHEMBL8154199

COc1ccc2c(OC)nc(C(F)(F)F)nc2c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.59
HPGD P15428 1/20 0.59
L3MBTL1 Q9Y468 1/20 0.59
LMNA P02545 2/20 0.48
RAB9A P51151 2/20 0.48
CCNE2 O96020 2/20 0.46
CCNE1 P24864 2/20 0.46
CDK2 P24941 2/20 0.46
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
ACHE P22303 1/20 0.43
KDM4E B2RXH2 2/20 0.41
ALDH1A1 P00352 2/20 0.41
NPC1 O15118 1/20 0.41
POLB P06746 1/20 0.41
NQO2 P16083 1/20 0.41
CYP1A2 P05177 2/20 0.40
CYP2C9 P11712 2/20 0.40
CYP3A4 P08684 1/20 0.40
VDR P11473 1/20 0.40

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
SCHEMBL15483478 0.84 LMNA (0.51) SMN1; SMN2HPGDL3MBTL1LMNARAB9A
SCHEMBL14509583 0.80 ALDH1A1 (0.58) SMN1; SMN2HPGDL3MBTL1CCNE2CCNE1
SCHEMBL8141768 0.79 PTGS1 (0.43) SMN1; SMN2HPGDL3MBTL1LMNARAB9A
SCHEMBL8138335 0.78 PDE3B (0.54) SMN1; SMN2HPGDL3MBTL1LMNARAB9A
SCHEMBL15483491 0.78 HPGD (0.44) SMN1; SMN2HPGDL3MBTL1LMNARAB9A
SCHEMBL8149547 0.77 ACHE (0.47) SMN1; SMN2HPGDL3MBTL1LMNARAB9A
SCHEMBL8145986 0.77 NPSR1 (0.48) SMN1; SMN2HPGDL3MBTL1LMNARAB9A
SCHEMBL13975120 0.75 PPM1A (0.44) SMN1; SMN2LMNARAB9AMEN1KMT2A
SCHEMBL25746206 0.74 HPGD (0.51) SMN1; SMN2HPGDL3MBTL1LMNACCNE2
SCHEMBL31283944 0.74 HPGD (0.51) SMN1; SMN2HPGDL3MBTL1LMNARAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140051626-A1 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. (US) 2014-02-20 US disclosed
US-8513186-B2 Antiviral compounds GILEAD SCIENCES, INC. (US) 2013-08-20 US disclosed
US-8513186-B2 Antiviral compounds GILEAD SCIENCES, INC. (US) 2013-08-20 US disclosed
US-20090186869-A1 Antiviral compounds GILEAD SCIENCES, INC. (US) 2009-07-23 US disclosed
US-20090186869-A1 Antiviral compounds GILEAD SCIENCES, INC. (US) 2009-07-23 US disclosed
WO-2009005677-A2 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. (US) 2009-01-08 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-20090186869-A1 Antiviral compounds MAVS, EIF2AK2, ZC3HAV1 SMN1; SMN2 1564/4885HPGD 3745/4885L3MBTL1 2200/4885
US-20140051626-A1 ANTIVIRAL COMPOUNDS MAVS, EIF2AK2, ZC3HAV1 SMN1; SMN2 1564/4885HPGD 3745/4885L3MBTL1 2200/4885

“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.