SCHEMBL2173625

SCHEMBL2173625

CCC(C)c1cc(O)c(-c2c(O)cc(C(C)CC)cc2C(C)CC)c(C(C)CC)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.48
ALOX15 P16050 2/20 0.46
HSD17B10 Q99714 2/20 0.46
USP2 O75604 1/20 0.46
ALDH1A1 P00352 1/20 0.46
GAA P10253 1/20 0.46
PKM P14618 1/20 0.46
HPGD P15428 1/20 0.46
RORC P51449 1/20 0.44
HDAC4 P56524 1/20 0.43
HDAC2 Q92769 1/20 0.43
HDAC8 Q9BY41 1/20 0.43
GABRA1 P14867 1/20 0.39
GABRB2 P47870 1/20 0.39
TDP1 Q9NUW8 5/20 0.36
KDM4E B2RXH2 4/20 0.36
MAPK1 P28482 1/20 0.36
HKDC1 Q2TB90 1/20 0.34
ADRB2 P07550 1/20 0.33
PTGS2 P35354 1/20 0.33

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
SCHEMBL1836944 0.81 TSHR (0.48) TSHRALOX15HSD17B10USP2ALDH1A1
SCHEMBL1116090 0.79 USP2 (0.52) TSHRALOX15HSD17B10USP2ALDH1A1
SCHEMBL23682242 0.79 USP2 (0.52) TSHRALOX15HSD17B10USP2ALDH1A1
SCHEMBL487428 0.78 GAA (0.67) TSHRALOX15HSD17B10USP2ALDH1A1
SCHEMBL69217 0.77 ALDH1A1 (0.50) TSHRALOX15HSD17B10USP2ALDH1A1
Methane SCHEMBL27627258 0.77 USP2 (0.50) TSHRALOX15HSD17B10USP2ALDH1A1
SCHEMBL3399797 0.76 GAA (0.59) TSHRALOX15HSD17B10USP2ALDH1A1
SCHEMBL15065156 0.76 TSHR (0.44) TSHRALOX15HSD17B10USP2ALDH1A1
SCHEMBL6744605 0.76 TSHR (0.44) TSHRALOX15HSD17B10USP2ALDH1A1
SCHEMBL14154101 0.76 GAA (0.59) TSHRALOX15HSD17B10USP2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2346887-B1 SLURRY PROCESS FOR SYNTHESIS OF BISPHOSPHITES DOW TECHNOLOGY INVESTMENTS LLC (US) 2013-12-25 EP disclosed
US-8546600-B2 Slurry process for synthesis of bisphosphites and situ use thereof for producing bisphosphite DOW TECHNOLOGY INVESTMENTS LLC 2013-10-01 US disclosed
US-20110196166-A1 SLURRY PROCESS FOR SYNTHESIS OF BISPHOSPHITES AND SITU USE THEREOF FOR PRODUCING BISPHOSPHITE DOW TECHNOLOGY INVESTMENTS LLC 2011-08-11 US disclosed
EP-2346887-A1 SLURRY PROCESS FOR SYNTHESIS OF BISPHOSPHITES Dow Technology Investments LLC (US) 2011-07-27 EP disclosed
WO-2010042313-A1 SLURRY PROCESS FOR SYNTHESIS OF BISPHOSPHITES DOW TECHNOLOGY INVESTMENTS LLC (US) 2010-04-15 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-20110196166-A1 SLURRY PROCESS FOR SYNTHESIS OF BISPHOSPHITES AND SITU USE THEREOF FOR PRODUCING BISPHOSPHITE SOST, PLCB3, PPIP5K2 TSHR 4332/4885ALOX15 2202/4885HSD17B10 3843/4885

“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.