SCHEMBL10304585

SCHEMBL10304585

O=C(CC1(P)CCCCC1)N1CCOCC1

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.46
TSHR P16473 2/20 0.42
ALOX15 P16050 1/20 0.42
HSD17B10 Q99714 1/20 0.42
SMN1; SMN2 Q16637 3/20 0.41
MEN1 O00255 1/20 0.40
TP53 P04637 1/20 0.40
KMT2A Q03164 1/20 0.40
LMNA P02545 2/20 0.39
POLB P06746 2/20 0.39
GAA P10253 1/20 0.39
HPGD P15428 1/20 0.39
ALDH1A1 P00352 2/20 0.38
KDM4E B2RXH2 1/20 0.38
GLA P06280 1/20 0.38

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
SCHEMBL29889649 0.70 BPTF (0.42) L3MBTL1TSHRALOX15HSD17B10SMN1; SMN2
SCHEMBL2137892 0.69 L3MBTL1 (0.59) L3MBTL1TSHRALOX15HSD17B10SMN1; SMN2
SCHEMBL3753324 0.68 L3MBTL1 (0.64) L3MBTL1TSHRALOX15HSD17B10SMN1; SMN2
SCHEMBL29889371 0.68 BPTF (0.43) L3MBTL1TSHRALOX15HSD17B10SMN1; SMN2
SCHEMBL11742016 0.67 L3MBTL1 (0.52) L3MBTL1TSHRALOX15HSD17B10SMN1; SMN2
SCHEMBL11922747 0.67 HSD17B10 (0.74) L3MBTL1TSHRALOX15HSD17B10SMN1; SMN2
SCHEMBL19574088 0.67 ATM (0.72) L3MBTL1TSHRSMN1; SMN2MEN1TP53
SCHEMBL18051852 0.67 SMN1; SMN2 (0.39) SMN1; SMN2MEN1TP53KMT2AHPGD
SCHEMBL15723527 0.67 SMN1; SMN2 (0.42) SMN1; SMN2MEN1TP53KMT2AGAA
SCHEMBL2262931 0.66 L3MBTL1 (0.61) L3MBTL1TSHRALOX15HSD17B10SMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3141252-A1 INHIBITORS OF INFLUENZA VIRUSES REPLICATION Vertex Pharmaceuticals Inc. (US) 2017-03-15 EP disclosed
US-9518056-B2 Inhibitors of influenza viruses replication VERTEX PHARMACEUTICALS INCORPORATED (US) 2016-12-13 US disclosed
US-20120171245-A1 INHIBITORS OF INFLUENZA VIRUSES REPLICATION VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-07-05 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 (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-20120171245-A1 INHIBITORS OF INFLUENZA VIRUSES REPLICATION ACE, IRF3, ACE2 L3MBTL1 4645/4885TSHR 2310/4885ALOX15 2809/4885

“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.