SCHEMBL7548252

SCHEMBL7548252

CC1(C)CCC(C)(C)c2cc(C=Cc3ccccc3)ccc21

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 11/20 0.69
RARG P13631 11/20 0.69
RARA P10276 9/20 0.69
CYP26A1 O43174 3/20 0.51
RXRA P19793 5/20 0.49
CYP26B1 Q9NR63 1/20 0.47
CYP3A4 P08684 2/20 0.46
CYP1A2 P05177 2/20 0.46
KDM4E B2RXH2 1/20 0.46
NPC1 O15118 1/20 0.46
GMNN O75496 1/20 0.46
USP2 O75604 1/20 0.46
ALDH1A1 P00352 1/20 0.46
LMNA P02545 1/20 0.46
TP53 P04637 1/20 0.46
POLB P06746 1/20 0.46
CYP2D6 P10635 1/20 0.46
NFKB1 P19838 1/20 0.46
CYP2C19 P33261 1/20 0.46
THPO P40225 1/20 0.46

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
SCHEMBL7548239 1.00 RARB (0.69) RARBRARGRARACYP26A1RXRA
SCHEMBL10645938 0.84 RARB (0.68) RARBRARGRARACYP26A1RXRA
SCHEMBL13636819 0.84 RARB (0.63) RARBRARGRARACYP26A1RXRA
SCHEMBL10645941 0.84 RARB (0.68) RARBRARGRARACYP26A1RXRA
SCHEMBL10643499 0.83 RARA (0.61) RARBRARGRARACYP1A2KDM4E
SCHEMBL10643492 0.83 RARA (0.61) RARBRARGRARACYP1A2KDM4E
SCHEMBL13636771 0.83 RARB (0.61) RARBRARGRARACYP26A1RXRA
SCHEMBL1616018 0.82 RARB (1.00) RARBRARGRARACYP26A1RXRA
SCHEMBL1615595 0.82 RARB (1.00) RARBRARGRARACYP26A1RXRA
SCHEMBL1615597 0.82 RARB (1.00) RARBRARGRARACYP26A1RXRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5001276-A Novel tetrahydronaphthalene and indane derivatives HOFFMANN-LA ROCHE INC. (US) 1991-03-19 US claimed
US-20020143062-A1 Method to incorporate N-(4-hydroxyphenyl) retinamide in liposomes BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2002-10-03 US disclosed
US-5055622-A For treating neoplasms and dermatoses HOFFMANN-LA ROCHE INC. (US) 1991-10-08 US disclosed
US-5030764-A Antitumor agents; treatment of skin disorders HOFFMANN-LA ROCHE INC. (US) 1991-07-09 US disclosed
US-5030765-A Skin disorders, anititumor agents HOFFMANN-LA ROCHE INC. (US) 1991-07-09 US disclosed
US-5001276-A Novel tetrahydronaphthalene and indane derivatives HOFFMANN-LA ROCHE INC. (US) 1991-03-19 US disclosed
US-4990703-A Novel tetrahydronaphthalene and indane derivatives HOFFMANN-LA ROCHE INC. (US) 1991-02-05 US disclosed
US-4935560-A ANTITUMOR AGENTS; SKIN DISORDERS HOFFMANN-LA ROCHE INC. (US) 1990-06-19 US disclosed
US-4870219-A NEOPLASMS, DERMATOSES HOFFMANN-LA ROCHE INC. (US) 1989-09-26 US disclosed