SCHEMBL7706265

SCHEMBL7706265

CC(=O)C1(C)CC=C(CCC=C(C)C)CC1C

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
ALDH1A1 P00352 3/20 0.46
FNTA P49354 2/20 0.46
PKM P14618 1/20 0.46
PGGT1B P53609 1/20 0.46
MCL1 Q07820 12/20 0.43
BCL2L1 Q07817 5/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MAPT P10636 1/20 0.41
FNTB P49356 1/20 0.41
BCL2 P10415 9/20 0.40

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
SCHEMBL10456239 0.81 MEN1 (0.47) MEN1KMT2AALDH1A1FNTAPKM
SCHEMBL7179918 0.78 MEN1 (0.50) MEN1KMT2AALDH1A1FNTAPKM
SCHEMBL623449 0.75 ALDH1A1 (0.35) ALDH1A1
SCHEMBL7173626 0.73 ALDH1A1 (0.30) ALDH1A1
SCHEMBL3840984 0.72 MEN1 (0.41) MEN1KMT2AALDH1A1FNTAPKM
SCHEMBL13714694 0.72 MEN1 (0.41) MEN1KMT2AALDH1A1FNTAPKM
SCHEMBL3840987 0.72 MEN1 (0.41) MEN1KMT2AALDH1A1FNTAPKM
SCHEMBL10356894 0.72 ALDH1A1 (0.41) ALDH1A1
SCHEMBL17385233 0.70 FNTA (0.53) MEN1KMT2AALDH1A1FNTAPKM
SCHEMBL7174967 0.70 MEN1 (0.45) MEN1KMT2AALDH1A1FNTAPKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2002544245-A 2002-12-24 JP claimed
EP-1178945-A1 REACTIONS USING LEWIS ACIDS QUEST INTERNATIONAL B.V. (NL) 2002-02-13 EP claimed
WO-2000069777-A1 REACTIONS USING LEWIS ACIDS QUEST INTERNATIONAL B.V. (NL) 2000-11-23 WO claimed
US-7678756-B2 Substituted hydrogenated naphthalene derivatives and their use in fragrance formulations INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2010-03-16 US disclosed
US-7678756-B2 Substituted hydrogenated naphthalene derivatives and their use in fragrance formulations INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2010-03-16 US disclosed
US-20090227685-A1 SUBSTITUTED HYDROGENATED NAPHTHALENE DERIVATIVES AND THEIR USE IN FRAGRANCE FORMULATIONS INTERNATIONAL FLAVORS & FRAGRANCES INC. 2009-09-10 US disclosed
US-20090227685-A1 SUBSTITUTED HYDROGENATED NAPHTHALENE DERIVATIVES AND THEIR USE IN FRAGRANCE FORMULATIONS INTERNATIONAL FLAVORS & FRAGRANCES INC. 2009-09-10 US disclosed
US-7375062-B1 Substituted hydrogenated naphthalene derivatives and their use in fragrance formulations INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2008-05-20 US disclosed
US-7375062-B1 Substituted hydrogenated naphthalene derivatives and their use in fragrance formulations INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2008-05-20 US disclosed
US-20080108544-A1 SUBSTITUTED HYDROGENATED NAPHTHALENE DERIVATIVES AND THEIR USE IN FRAGRANCE FORMULATIONS INTERNATIONAL FLAVORS & FRAGRANCES INC. 2008-05-08 US disclosed
US-20080108544-A1 SUBSTITUTED HYDROGENATED NAPHTHALENE DERIVATIVES AND THEIR USE IN FRAGRANCE FORMULATIONS INTERNATIONAL FLAVORS & FRAGRANCES INC. 2008-05-08 US disclosed
EP-1178945-A1 REACTIONS USING LEWIS ACIDS QUEST INTERNATIONAL B.V. (NL) 2002-02-13 EP disclosed
WO-2000069777-A1 REACTIONS USING LEWIS ACIDS QUEST INTERNATIONAL B.V. (NL) 2000-11-23 WO 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 (2 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-20080108544-A1 SUBSTITUTED HYDROGENATED NAPHTHALENE DERIVATIVES AND THEIR USE IN FRAGRANCE FORMULATIONS H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, H1-10, H1-0 MEN1 2099/4885KMT2A 548/4885ALDH1A1 367/4885
US-20090227685-A1 SUBSTITUTED HYDROGENATED NAPHTHALENE DERIVATIVES AND THEIR USE IN FRAGRANCE FORMULATIONS H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, HRH4, HRH1 MEN1 2837/4885KMT2A 866/4885ALDH1A1 333/4885

“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.