SCHEMBL7705102

SCHEMBL7705102

COc1ccc(N2CCN(CC(O)COc3ccc(OCc4ccccc4)cc3)CC2)c(OC)c1

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.61
RAB9A P51151 1/20 0.61
HSD17B10 Q99714 1/20 0.61
L3MBTL1 Q9Y468 2/20 0.61
CACNA1G O43497 2/20 0.61
MAPK1 P28482 1/20 0.61
KCNH2 Q12809 1/20 0.61
POLB P06746 1/20 0.60
KMT2A Q03164 3/20 0.59
GAA P10253 1/20 0.59
ABCB1 P08183 5/20 0.59
MAPT P10636 4/20 0.59
LMNA P02545 1/20 0.58
HSP90AB1 P08238 1/20 0.57
MEN1 O00255 2/20 0.57
ALDH1A1 P00352 2/20 0.57

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
SCHEMBL7711033 0.92 TSHR (0.61) TSHRRAB9AHSD17B10L3MBTL1CACNA1G
SCHEMBL7705078 0.89 MEN1 (0.61) L3MBTL1CACNA1GMAPK1KCNH2POLB
Hydrochloric Acid SCHEMBL7711666 0.88 MEN1 (0.63) L3MBTL1CACNA1GMAPK1KCNH2POLB
SCHEMBL7711663 0.86 KMT2A (0.64) TSHRRAB9AHSD17B10L3MBTL1CACNA1G
SCHEMBL4751011 0.84 MEN1 (0.68) TSHRCACNA1GMAPK1KCNH2KMT2A
SCHEMBL14355279 0.83 HSP90AB1 (0.56) TSHRL3MBTL1CACNA1GMAPK1KCNH2
SCHEMBL17313697 0.82 KCNH2 (0.78) TSHRL3MBTL1CACNA1GMAPK1KCNH2
SCHEMBL7705100 0.82 MAPT (0.69) TSHRHSD17B10CACNA1GMAPK1KCNH2
SCHEMBL7711545 0.81 MAPT (0.71) TSHRHSD17B10CACNA1GMAPK1KCNH2
SCHEMBL12259197 0.81 MAPT (0.76) TSHRRAB9AHSD17B10L3MBTL1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6358515-B2 ANTIHYPERTENSIVE PHARMACEUTICAL COMPOSITION; TREATMENT OF GLAUCOMA SENJU PHARMACEUTICAL CO., LTD. (JP) 2002-03-19 US claimed
US-20010008893-A1 HYDROQUINONE DERIVATIVES SENJU PHARMACEUTICAL CO., LTD. (JP) 2001-07-19 US claimed
EP-0972766-A1 HYDROQUINONE DERIVATIVES Senju Pharmaceutical Co., Ltd. (JP) 2000-01-19 EP claimed
US-6358515-B2 ANTIHYPERTENSIVE PHARMACEUTICAL COMPOSITION; TREATMENT OF GLAUCOMA SENJU PHARMACEUTICAL CO., LTD. (JP) 2002-03-19 US disclosed
US-20010008893-A1 HYDROQUINONE DERIVATIVES SENJU PHARMACEUTICAL CO., LTD. (JP) 2001-07-19 US disclosed
EP-0972766-A1 HYDROQUINONE DERIVATIVES Senju Pharmaceutical Co., Ltd. (JP) 2000-01-19 EP 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-20010008893-A1 HYDROQUINONE DERIVATIVES REN, AGTR1, AGTR2 TSHR 3363/4885RAB9A 1101/4885HSD17B10 296/4885

“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.