SCHEMBL8232147

SCHEMBL8232147

CCCCOC[C@@H](CO)C(C)C

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.50
TSHR P16473 1/20 0.46
SPHK1 Q9NYA1 1/20 0.41
HTT P42858 2/20 0.40
HSD17B10 Q99714 1/20 0.40
MEN1 O00255 1/20 0.38
THRB P10828 1/20 0.38
KMT2A Q03164 1/20 0.38
MAPT P10636 1/20 0.38
PLA2G2C Q5R387 1/20 0.36
CYP3A4 P08684 1/20 0.35
LPAR1 Q92633 5/20 0.35
LPAR3 Q9UBY5 5/20 0.35
LPAR5 Q9H1C0 4/20 0.35
LPAR2 Q9HBW0 4/20 0.35
LPAR6 P43657 3/20 0.35
LPAR4 Q99677 3/20 0.35
ALDH1A1 P00352 1/20 0.35
TDP1 Q9NUW8 1/20 0.34

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
SCHEMBL11966890 0.82 USP2 (0.36) USP2TSHRHSD17B10
SCHEMBL1638734 0.81 USP2 (0.38) USP2TSHRSPHK1HTTHSD17B10
SCHEMBL8223606 0.79 USP2 (0.37) USP2TSHRSPHK1HTTHSD17B10
SCHEMBL14612347 0.78 USP2 (0.53) USP2TSHRSPHK1HTTHSD17B10
SCHEMBL10611228 0.78 USP2 (0.53) USP2TSHRSPHK1HTTHSD17B10
SCHEMBL12586740 0.78 USP2 (0.53) USP2TSHRSPHK1HTTHSD17B10
SCHEMBL17539150 0.77 USP2 (0.52) USP2TSHRSPHK1HTTHSD17B10
SCHEMBL19738340 0.76 USP2 (0.43) USP2TSHRSPHK1HTTMEN1
SCHEMBL17278043 0.76 USP2 (0.55) USP2TSHRSPHK1HTTHSD17B10
Propylene Glycol SCHEMBL27892627 0.75 USP2 (0.55) USP2TSHRSPHK1HTTHSD17B10

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
US-8084485-B2 6-(aminoalkyl)indazoles VITAE PHARMACEUTICALS, INC. (US) 2011-12-27 US disclosed
US-20100331287-A1 6-(Aminoalkyl)Indazoles VITAE PHARMACEUTICALS, INC. 2010-12-30 US disclosed
WO-2007120523-A2 6-(AMINOALKYL)INDAZOLES VITAE PHARMACEUTICALS, INC. (US) 2007-10-25 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 (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-20100331287-A1 6-(Aminoalkyl)Indazoles REN, AGTR1, AGTR2 USP2 3666/4885TSHR 4447/4885SPHK1 2542/4885

“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.