SCHEMBL4860974

SCHEMBL4860974

C=C(C(=O)OCCC12CC3CC(CC(CCO)(C3)C1)C2)C(F)(F)F

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.37
KMT2A Q03164 4/20 0.37
ALDH1A1 P00352 5/20 0.36
MAPT P10636 1/20 0.36
ATM Q13315 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
THRB P10828 1/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35
GAA P10253 1/20 0.33
TGM2 P21980 1/20 0.31
CYP2D6 P10635 1/20 0.31

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
SCHEMBL4854862 0.89 ALDH1A1 (0.37) MEN1KMT2AALDH1A1MAPTATM
SCHEMBL4862129 0.84 MEN1 (0.36) MEN1KMT2AALDH1A1MAPTATM
SCHEMBL3229380 0.83 MEN1 (0.43) MEN1KMT2AALDH1A1MAPTATM
SCHEMBL4862842 0.82 MEN1 (0.37) MEN1KMT2AALDH1A1MAPTATM
SCHEMBL4118290 0.80 ALDH1A1 (0.35) MEN1KMT2AALDH1A1L3MBTL1THRB
SCHEMBL17928898 0.76 MEN1 (0.47) MEN1KMT2AALDH1A1MAPTATM
SCHEMBL4865784 0.76 ALDH1A1 (0.35) MEN1KMT2AALDH1A1L3MBTL1THRB
SCHEMBL5942019 0.76 ALDH1A1 (0.47) MEN1KMT2AALDH1A1MAPTATM
SCHEMBL4858002 0.76 TSHR (0.46) MEN1KMT2AALDH1A1MAPTATM
SCHEMBL4858798 0.74 ALDH1A1 (0.34) MEN1KMT2AALDH1A1L3MBTL1THRB

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
CN-101027281-B Adamantane derivative, process for producing the same, and photosensitive material for photoresist IDEMITSU PETROCHEMICAL CO 2011-04-20 CN disclosed
CN-101671287-A Adamantane derivative and photosensitive material for photoresist IDEMITSU KOSAN CO 2010-03-17 CN disclosed
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
CN-101027281-A Adamantane derivative, process for producing the same, and photosensitive material for photoresist IDEMITSU KOSAN CO (JP) 2007-08-29 CN 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 MEN1 1643/4885KMT2A 2612/4885ALDH1A1 1544/4885

“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.