SCHEMBL803574

SCHEMBL803574

CCCCCOC(=O)C(c1ccccc1)C(C)(C)C

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.56
ATM Q13315 1/20 0.56
NPC1 O15118 2/20 0.53
RAB9A P51151 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
LMNA P02545 2/20 0.53
TSHR P16473 3/20 0.51
TP53 P04637 1/20 0.51
CYP3A4 P08684 1/20 0.51
MAPK1 P28482 1/20 0.51
ALDH1A1 P00352 2/20 0.50
TDP1 Q9NUW8 1/20 0.45
KDM4E B2RXH2 1/20 0.44
POLB P06746 1/20 0.44
HSD17B10 Q99714 1/20 0.44

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
SCHEMBL803632 1.00 L3MBTL1 (0.56) L3MBTL1ATMNPC1RAB9ASMN1; SMN2
SCHEMBL803638 0.95 L3MBTL1 (0.58) L3MBTL1ATMNPC1RAB9ASMN1; SMN2
SCHEMBL803805 0.95 L3MBTL1 (0.58) L3MBTL1ATMNPC1RAB9ASMN1; SMN2
SCHEMBL28862621 0.89 ATM (0.61) L3MBTL1ATMNPC1RAB9ASMN1; SMN2
SCHEMBL28798996 0.86 NPC1 (0.51) NPC1RAB9ASMN1; SMN2LMNATSHR
SCHEMBL28325223 0.82 L3MBTL1 (0.46) L3MBTL1ATMNPC1RAB9ASMN1; SMN2
SCHEMBL803808 0.82 ATM (0.65) L3MBTL1ATMNPC1SMN1; SMN2TSHR
SCHEMBL803886 0.82 ATM (0.65) L3MBTL1ATMNPC1SMN1; SMN2TSHR
SCHEMBL803631 0.82 ATM (0.56) L3MBTL1ATMSMN1; SMN2LMNATSHR
SCHEMBL803575 0.82 ATM (0.56) L3MBTL1ATMSMN1; SMN2LMNATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8785655-B2 Ionic liquid solvents DUBLIN CITY UNIVERSITY (IE) 2014-07-22 US disclosed
US-20120071661-A1 Ionic Liquid Solvents DUBLIN CITY UNIVERSITY (IE) 2012-03-22 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-20120071661-A1 Ionic Liquid Solvents EBP, PAICS, HACD3 L3MBTL1 272/4885ATM 4829/4885NPC1 1252/4885

“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.