SCHEMBL6311542

SCHEMBL6311542

Cc1cc2c(O[Si](C)(C)C(C)(C)C)cccc2o1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.38
ALDH1A1 P00352 3/20 0.38
HPGD P15428 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HSD17B10 Q99714 1/20 0.38
CA12 O43570 5/20 0.37
CA1 P00915 5/20 0.37
CA9 Q16790 5/20 0.37
CA2 P00918 1/20 0.37
CYP2A6 P11509 2/20 0.34
CNR2 P34972 1/20 0.33
CYP1A2 P05177 5/20 0.33
CYP1A1 P04798 4/20 0.33
CYP1B1 Q16678 4/20 0.33
ADRB2 P07550 1/20 0.33
ACHE P22303 1/20 0.33
MAOA P21397 2/20 0.33
MEN1 O00255 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32

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
SCHEMBL30189986 0.80 KDM4E (0.41) KDM4EHSD17B10CA12CA1CA9
SCHEMBL19782520 0.80 KDM4E (0.41) KDM4EHSD17B10CA12CA1CA9
SCHEMBL9296788 0.76 CYP2A6 (0.56) KDM4EALDH1A1HPGDSMN1; SMN2HSD17B10
SCHEMBL19460974 0.74 KCNA3 (0.44) KDM4EALDH1A1HPGDCA12CA1
SCHEMBL13171932 0.72 CYP1A2 (0.47) KDM4EALDH1A1HPGDHSD17B10CA12
SCHEMBL21194985 0.72 MAOA (0.64) KDM4EALDH1A1HPGDSMN1; SMN2HSD17B10
SCHEMBL17977220 0.71 ALDH1A1 (0.47) KDM4EALDH1A1HPGDHSD17B10
SCHEMBL30556213 0.71 CA1 (0.38) ALDH1A1SMN1; SMN2CA12CA1CA9
SCHEMBL3183646 0.71 CA12 (0.38) CA12CA1CA9
SCHEMBL10920394 0.70 F2RL3 (0.47) KDM4EALDH1A1HPGDSMN1; SMN2HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10202360-B2 Therapeutic compounds CELGENE QUANTICEL RESEARCH, INC. (US) 2019-02-12 US disclosed
US-20170298040-A1 THERAPEUTIC COMPOUNDS CELGENE QUANTICEL RESEARCH, INC. 2017-10-19 US disclosed
US-20170298040-A1 THERAPEUTIC COMPOUNDS CELGENE QUANTICEL RESEARCH, INC. 2017-10-19 US disclosed
US-6844344-B2 Benzofuran derivatives ELI LILLY AND COMPANY (US) 2005-01-18 US disclosed
US-20030232833-A1 Benzofuran derivatives ELI LILLY AND COMPANY 2003-12-18 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 (3 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-10202360-B2 Therapeutic compounds EP300, BRDT, BRPF3 KDM4E 160/4885ALDH1A1 3826/4885HPGD 1438/4885
US-20030232833-A1 Benzofuran derivatives BRD1, BPTF, HTR1F KDM4E 588/4885ALDH1A1 90/4885HPGD 516/4885
US-20170298040-A1 THERAPEUTIC COMPOUNDS EP300, BRDT, BRPF3 KDM4E 160/4885ALDH1A1 3826/4885HPGD 1438/4885

“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.