SCHEMBL14527437

SCHEMBL14527437

CC(C)c1cnc(CC(=O)c2ccccc2)nc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 4/20 0.43
▸ BCHE P06276 3/20 0.43
▸ ACHE P22303 3/20 0.43
▸ USP5 P45974 1/20 0.42
▸ ALDH1A1 P00352 5/20 0.42
▸ KDM4E B2RXH2 3/20 0.42
▸ MAPT P10636 3/20 0.42
▸ SMN1; SMN2 Q16637 3/20 0.42
▸ TDP1 Q9NUW8 2/20 0.42
▸ LMNA P02545 2/20 0.42
▸ L3MBTL1 Q9Y468 2/20 0.42
▸ APAF1 O14727 1/20 0.42
▸ MITF O75030 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ GLA P06280 1/20 0.41
▸ MAPK1 P28482 2/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ CYP3A4 P08684 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ ALOX15 P16050 1/20 0.41

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
SCHEMBL14548583 0.81 MEN1 (0.50) HPGDBCHEACHEALDH1A1KDM4E
SCHEMBL7099644 0.75 HTR1D (0.50) BCHEACHE
SCHEMBL3917034 0.75 NPC1 (0.56) USP5ALDH1A1MAPTSMN1; SMN2L3MBTL1
SCHEMBL19756422 0.71 MAPT (0.39) HPGDALDH1A1KDM4EMAPTSMN1; SMN2
SCHEMBL3918379 0.71 MAPT (0.47) HPGDBCHEALDH1A1KDM4EMAPT
SCHEMBL13542114 0.71 CCNE1 (0.55) SMN1; SMN2LMNAL3MBTL1HTTCYP3A4
SCHEMBL16310946 0.70 CAPN1 (0.44) LMNA
Dibenzoylmethane SCHEMBL5680105 0.70 KMT2A (0.65) HPGDUSP5ALDH1A1KDM4EMAPT
SCHEMBL38900 0.70 KMT2A (0.65) HPGDUSP5ALDH1A1KDM4EMAPT
Isobutane SCHEMBL1801676 0.70 MAPT (0.63) HPGDALDH1A1KDM4EMAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070082901-A1 Pyrazolopyrimidines as protein kinase inhibitors SCHERING CORPORATION 2007-04-12 — — 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 (1 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-20070082901-A1 Pyrazolopyrimidines as protein kinase inhibitors CHEK1, CHEK2, BUB1 HPGD 2835/4885BCHE 3676/4885ACHE 3568/4885

“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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