SCHEMBL430973

SCHEMBL430973

CC1(C)CC=C(N2CCCC2)CC1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.42
HPGD P15428 1/20 0.42
NPC1 O15118 5/20 0.37
SMN1; SMN2 Q16637 5/20 0.37
RAB9A P51151 4/20 0.37
LMNA P02545 2/20 0.37
APOBEC3A P31941 2/20 0.37
APOBEC3G Q9HC16 2/20 0.37
CTDSP1 Q9GZU7 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
HTT P42858 4/20 0.36
NR2F2 P24468 2/20 0.36
ALDH1A1 P00352 2/20 0.36
NOD2 Q9HC29 1/20 0.36
GALR3 O60755 1/20 0.36
MITF O75030 1/20 0.33
NPY1R P25929 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
SCHEMBL1160912 0.83 APOBEC3A (0.41) MAPTNPC1SMN1; SMN2RAB9ALMNA
SCHEMBL13004982 0.78 MAPT (0.34) MAPTHPGDNPC1SMN1; SMN2RAB9A
SCHEMBL9749472 0.78 MAPT (0.35) MAPTHPGDNPC1SMN1; SMN2RAB9A
SCHEMBL11449820 0.74 GRIN1 (0.37)
SCHEMBL11823955 0.68 MAPT (0.50) MAPTHPGDNPC1SMN1; SMN2RAB9A
SCHEMBL11021834 0.67 PTPN11 (0.36) MAPTHPGDALDH1A1
SCHEMBL28769174 0.65 MAPT (0.36) MAPTHPGDNPC1SMN1; SMN2RAB9A
SCHEMBL497532 0.64 MAPT (0.38) MAPTHPGDLMNAALDH1A1
SCHEMBL4837023 0.64
SCHEMBL24581679 0.64 OPRM1 (0.43)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11739066-B2 Method for fluoroalkylation of enamines ARXADA AG (CH) 2023-08-29 US disclosed
US-11739066-B2 Method for fluoroalkylation of enamines ARXADA AG (CH) 2023-08-29 US disclosed
US-20220204464-A1 Method for Fluoroalkylation of Enamines LONZA LTD (CH) 2022-06-30 US disclosed
US-20120065195-A1 COMPOUNDS FOR TREATING NEURODEGENERATIVE DISEASES ARRAY BIOPHARMA INC. 2012-03-15 US disclosed
US-20120065195-A1 COMPOUNDS FOR TREATING NEURODEGENERATIVE DISEASES ARRAY BIOPHARMA INC. 2012-03-15 US disclosed
US-20120065195-A1 COMPOUNDS FOR TREATING NEURODEGENERATIVE DISEASES ARRAY BIOPHARMA INC. 2012-03-15 US disclosed
WO-2011123674-A1 COMPOUNDS FOR TREATING NEURODEGENERATIVE DISEASES ARRAY BIOPHARMA INC. (US) 2011-10-06 WO disclosed
WO-2011123674-A1 COMPOUNDS FOR TREATING NEURODEGENERATIVE DISEASES ARRAY BIOPHARMA INC. (US) 2011-10-06 WO disclosed
US-20060205772-A1 Amide derivatives and their use as inhibitors of 11-beta-hydroxysteroid dehydrogenase type I COPPOLA GARY M 2006-09-14 US disclosed
EP-1590319-A1 AMIDE DERIVATIVES AND THEIR USE AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 Novartis AG (CH) 2005-11-02 EP disclosed
WO-2004065351-A1 AMIDE DERIVATIVES AND THEIR USE AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 NOVARTIS AG (CH) 2004-08-05 WO disclosed
US-4221800-A ANTIALLERGENS, ANTIHISTAMINES MILES LABORATORIES, INC. (US) 1980-09-09 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 (4 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-20060205772-A1 Amide derivatives and their use as inhibitors of 11-beta-hydroxysteroid dehydrogenase type I HSD11B1, HSD11B2, CYP11B1 MAPT 4655/4885HPGD 239/4885NPC1 1136/4885
US-20120065195-A1 COMPOUNDS FOR TREATING NEURODEGENERATIVE DISEASES APP, BACE1, PSEN1 MAPT 14/4885HPGD 303/4885NPC1 45/4885
US-11739066-B2 Method for fluoroalkylation of enamines HNMT, PNMT, INMT MAPT 3997/4885HPGD 2837/4885NPC1 959/4885
US-20220204464-A1 Method for Fluoroalkylation of Enamines HNMT, PNMT, INMT MAPT 3997/4885HPGD 2837/4885NPC1 959/4885

“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.