SCHEMBL18969720

SCHEMBL18969720

CCC(C)(c1ccc(OC(=O)c2ccc(C(=O)Oc3ccc(C(C)(CC)c4ccc(OC(=O)c5ccc(C(=O)Oc6ccccc6OC)cc5)cc4)cc3)cc2)cc1)c1ccc(OC(=O)c2ccc(C(=O)Oc3ccccc3OC)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.53
NPSR1 Q6W5P4 2/20 0.53
L3MBTL1 Q9Y468 2/20 0.52
TDP1 Q9NUW8 1/20 0.52
PRSS1 P07477 3/20 0.50
ACR P10323 3/20 0.50
TSHR P16473 1/20 0.48
KMT2A Q03164 5/20 0.45
PARP10 Q53GL7 1/20 0.44
ESR1 P03372 1/20 0.43
ESR2 Q92731 1/20 0.43
MEN1 O00255 1/20 0.43
NPC1 O15118 1/20 0.42
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
PTPN1 P18031 1/20 0.41

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
SCHEMBL19007367 0.93 MAPT (0.47) MAPTNPSR1L3MBTL1TDP1PRSS1
SCHEMBL19007366 0.92 HPGD (0.55) MAPTNPSR1L3MBTL1TDP1PRSS1
SCHEMBL18969715 0.87 MAPT (0.58) MAPTNPSR1L3MBTL1TDP1PRSS1
SCHEMBL141556 0.83 CA1 (0.58) MAPTL3MBTL1TDP1PRSS1ACR
SCHEMBL19007365 0.80 MAPT (0.51) MAPTNPSR1L3MBTL1TDP1PRSS1
SCHEMBL21159215 0.79 KMT2A (0.67) MAPTL3MBTL1PRSS1ACRKMT2A
SCHEMBL18591531 0.79 MAPT (0.47) MAPTL3MBTL1TDP1PRSS1ACR
SCHEMBL12520418 0.78 PRSS1 (0.73) MAPTL3MBTL1TDP1PRSS1ACR
SCHEMBL14007591 0.78 MAPT (0.48) MAPTNPSR1L3MBTL1TDP1PRSS1
SCHEMBL19007369 0.78 MAPT (0.51) MAPTNPSR1L3MBTL1TDP1PRSS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170166513-A1 EPOXY RESIN CURING AGENT AND PREPARATION METHODS AND USES THEREOF GUANGDONG GUANGSHAN NEW MATERIALS CO., LTD. (CN) 2017-06-15 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-20170166513-A1 EPOXY RESIN CURING AGENT AND PREPARATION METHODS AND USES THEREOF EPHX1, EPHX2, EED MAPT 2929/4885NPSR1 4374/4885L3MBTL1 4333/4885

“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.