SCHEMBL21024080

SCHEMBL21024080

CC(C)c1cnc2c(c1)n(C)c(=O)n2C

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 2/20 0.59
▸ HPGD P15428 2/20 0.59
▸ HTT P42858 1/20 0.59
▸ ATAD2 Q6PL18 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ PDE4D Q08499 2/20 0.38
▸ BRPF1 P55201 2/20 0.38
▸ PIK3CD O00329 2/20 0.38
▸ ADORA3 P0DMS8 2/20 0.38
▸ ADORA2A P29274 2/20 0.38
▸ ADORA2B P29275 2/20 0.38
▸ ADORA1 P30542 2/20 0.38
▸ ALPL P05186 1/20 0.38
▸ TMIGD3 P0DMS9 1/20 0.38
▸ PDE4A P27815 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ PDE4B Q07343 1/20 0.38
▸ PDE4C Q08493 1/20 0.38
▸ HIF1A Q16665 1/20 0.38

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
SCHEMBL15341934 0.77 HSD17B10 (0.46) HSD17B10HPGDHTTGRIN1GRIN2B
SCHEMBL19657540 0.76 HSD17B10 (0.65) HSD17B10HPGDHTTATAD2ALDH1A1
SCHEMBL25407471 0.74 HSD17B10 (0.62) HSD17B10HPGDHTTATAD2KDM4E
SCHEMBL30349792 0.74 HSD17B10 (0.62) HSD17B10HPGDHTTATAD2KDM4E
SCHEMBL3513392 0.74 HSD17B10 (1.00) HSD17B10HPGDHTTATAD2ALDH1A1
SCHEMBL13340940 0.72 BRPF1 (0.57) HSD17B10HPGDHTTATAD2KDM4E
SCHEMBL19657535 0.71 HSD17B10 (0.59) HSD17B10HPGDHTTPDE4DPDE6A
SCHEMBL11922125 0.71 HSD17B10 (0.59) HSD17B10HPGDHTTATAD2ALDH1A1
SCHEMBL17813540 0.71 PDE3B (0.45) HPGDHTTKDM4EALDH1A1ADORA2A
SCHEMBL29311521 0.70 HSD17B10 (0.57) HSD17B10HPGDHTTALDH1A1PDE4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10696655-B2 Therapeutic compounds and uses thereof GENENTECH, INC. (US) 2020-06-30 — — US disclosed
US-20190152949-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2019-05-23 — — 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 (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-20190152949-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF EP300, HDAC1, HDAC11 HSD17B10 1496/4885HPGD 2208/4885HTT 1145/4885
US-10696655-B2 Therapeutic compounds and uses thereof EP300, HDAC1, HDAC11 HSD17B10 1496/4885HPGD 2208/4885HTT 1145/4885

“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.

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