SCHEMBL8668538

SCHEMBL8668538

COc1ccc2[nH]c3c4c(=O)c5ccccc5c(=O)c4c4c(=O)c5ccccc5c(=O)c4c3c2c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ABCG2 Q9UNQ0 2/20 0.62
▸ ROCK2 O75116 3/20 0.62
▸ PDGFRB P09619 1/20 0.58
▸ ALDH1A1 P00352 4/20 0.56
▸ MEN1 O00255 3/20 0.56
▸ KMT2A Q03164 3/20 0.56
▸ HPGD P15428 3/20 0.56
▸ KDM4E B2RXH2 2/20 0.56
▸ MAPT P10636 2/20 0.56
▸ HSD17B10 Q99714 2/20 0.56
▸ GSK3A P49840 2/20 0.54
▸ GSK3B P49841 2/20 0.54
▸ DYRK1A Q13627 3/20 0.53
▸ STING1 Q86WV6 1/20 0.52
▸ CCNE2 O96020 1/20 0.52
▸ CDK4 P11802 1/20 0.52
▸ CCND1 P24385 1/20 0.52
▸ CCNE1 P24864 1/20 0.52
▸ CDK2 P24941 1/20 0.52
▸ CAMK2B Q13554 1/20 0.52

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
SCHEMBL8666953 0.81 ALDH1A1 (0.50) ABCG2ALDH1A1MEN1KMT2AHPGD
SCHEMBL5879238 0.81 PDGFRB (0.62) ABCG2ROCK2PDGFRBALDH1A1MEN1
SCHEMBL4703362 0.78 CHEK1 (0.67) ALDH1A1MEN1KMT2AHPGDKDM4E
SCHEMBL8667677 0.78 CDK2 (0.50) ROCK2ALDH1A1MEN1KMT2AHPGD
SCHEMBL5442946 0.77 ABCG2 (1.00) ABCG2ROCK2ALDH1A1MEN1KMT2A
SCHEMBL30213441 0.77 ABCG2 (1.00) ABCG2ROCK2ALDH1A1MEN1KMT2A
SCHEMBL8128623 0.77 ROCK2 (1.00) ROCK2PDGFRBMEN1KMT2AMAPT
SCHEMBL13377736 0.77 ABCG2 (0.61) ABCG2ROCK2PDGFRBALDH1A1MEN1
SCHEMBL21563913 0.75 CDK4 (0.63) ABCG2ROCK2PDGFRBALDH1A1MEN1
SCHEMBL21563916 0.75 STING1 (0.53) ABCG2ROCK2PDGFRBALDH1A1MEN1

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
EP-0649406-B1 CARBAZOLE DERIVATIVES AND THEIR USE IN COSMETICS, ESPECIALLY FOR MAKE-UP OREAL (FR) 1998-12-23 — — EP claimed
US-5543436-A USED AS PIGMENTS IN COSMETICS, PARTICULARLY INTENDED FOR TREATMENT AND/OR COLORATION OF KERATINOUS SUBSTANCES L'OREAL (FR) 1996-08-06 — — US claimed
US-5543436-A USED AS PIGMENTS IN COSMETICS, PARTICULARLY INTENDED FOR TREATMENT AND/OR COLORATION OF KERATINOUS SUBSTANCES L'OREAL (FR) 1996-08-06 — — US disclosed
Send feedback