SCHEMBL4865327

SCHEMBL4865327

C=CC(=O)OCC12CC3CC(C1)CC(OCCCSCCC)(C3)C2

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.35
TSHR P16473 1/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
DPP8 Q6V1X1 1/20 0.34
DPP9 Q86TI2 1/20 0.34
ALDH1A1 P00352 3/20 0.33
MAPT P10636 1/20 0.31
ATM Q13315 1/20 0.31
THRB P10828 1/20 0.30

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
SCHEMBL4860247 0.87 TSHR (0.36) HPGDTSHRMEN1KMT2AL3MBTL1
SCHEMBL4863687 0.84 MEN1 (0.36) HPGDTSHRMEN1KMT2AL3MBTL1
SCHEMBL4864083 0.82 L3MBTL1 (0.34) HPGDTSHRMEN1KMT2AL3MBTL1
SCHEMBL4858926 0.80 TSHR (0.38) HPGDTSHRMEN1KMT2AL3MBTL1
SCHEMBL4858689 0.80 TSHR (0.37) HPGDTSHRMEN1KMT2AL3MBTL1
SCHEMBL4865342 0.78 MEN1 (0.34) HPGDTSHRMEN1KMT2AL3MBTL1
SCHEMBL4861207 0.78 TSHR (0.38) HPGDTSHRMEN1KMT2AL3MBTL1
SCHEMBL4856940 0.78 DPP8 (0.37) HPGDTSHRDPP8DPP9THRB
SCHEMBL5184861 0.78 TSHR (0.40) HPGDTSHRMEN1KMT2AL3MBTL1
SCHEMBL16708438 0.76 ALDH1A1 (0.39) TSHRMEN1KMT2AL3MBTL1ALDH1A1

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-7456311-B2 Adamantane derivative, process for producing the same, and photosensitive material for photoresist IDEMITSU KOSAN CO., LTD. (JP) 2008-11-25 US disclosed
US-20080009647-A1 Adamantane Derivative, Process for Producing the Same, and Photosensitive Material for Photoresist IDEMITSU KOSAN CO., LTD. (JP) 2008-01-10 US disclosed
EP-1803708-A1 ADAMANTANE DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND PHOTOSENSITIVE MATERIAL FOR PHOTORESIST IDEMITSU KOSAN CO., LTD. (JP) 2007-07-04 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-20080009647-A1 Adamantane Derivative, Process for Producing the Same, and Photosensitive Material for Photoresist LSS, C1S, DHPS HPGD 611/4885TSHR 3738/4885MEN1 1643/4885

“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.