SCHEMBL10134675

SCHEMBL10134675

CCN1CCCC1CNc1nc2cnccc2c2cnccc12

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.47
KDM4E B2RXH2 4/20 0.43
ALDH1A1 P00352 4/20 0.43
HSD17B10 Q99714 4/20 0.43
HPGD P15428 3/20 0.43
LMNA P02545 2/20 0.43
POLB P06746 1/20 0.43
ACHE P22303 1/20 0.43
IRAK4 Q9NWZ3 2/20 0.42
CYP3A4 P08684 1/20 0.41
TSHR P16473 1/20 0.41
PIM1 P11309 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
USP2 O75604 1/20 0.39
PIM2 Q9P1W9 1/20 0.39
LATS1 O95835 3/20 0.39
LATS2 Q9NRM7 3/20 0.39
VNN1 O95497 1/20 0.38
KAT2B Q92831 1/20 0.37

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
SCHEMBL10131789 0.86 CSNK2A1 (0.59)
SCHEMBL11932670 0.79 DRD2 (0.41) DRD2KDM4EALDH1A1HSD17B10HPGD
SCHEMBL3327772 0.79 PRKCD (0.54) DRD2KDM4EALDH1A1HSD17B10HPGD
SCHEMBL10137146 0.76 PIM1 (0.41) DRD2KDM4EALDH1A1HSD17B10HPGD
SCHEMBL22201647 0.74 HPGD (0.54) KDM4EALDH1A1HSD17B10HPGDLMNA
SCHEMBL22639730 0.72 ACHE (0.51) DRD2KDM4EALDH1A1HSD17B10HPGD
SCHEMBL13688079 0.72 KDM4E (0.42) DRD2KDM4EALDH1A1HSD17B10HPGD
SCHEMBL10134795 0.70 SLC6A4 (0.41) DRD2KDM4EALDH1A1HSD17B10HPGD
SCHEMBL30214064 0.69 IL1B (0.50) DRD2KDM4EALDH1A1HSD17B10HPGD
SCHEMBL28961866 0.69 ACHE (0.53) DRD2KDM4EALDH1A1HSD17B10HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120208792-A1 PROTEIN KINASE MODULATORS CYLENE PHARMACEUTICALS, INC. (US) 2012-08-16 US disclosed
US-20120208792-A1 PROTEIN KINASE MODULATORS CYLENE PHARMACEUTICALS, INC. (US) 2012-08-16 US disclosed
US-8168651-B2 Protein kinase modulators CYLENE PHARMACEUTICALS, INC. (US) 2012-05-01 US disclosed
US-8168651-B2 Protein kinase modulators CYLENE PHARMACEUTICALS, INC. (US) 2012-05-01 US disclosed
US-20090239859-A1 PROTEIN KINASE MODULATORS SENHWA BIOSCIENCES, INC. (TW) 2009-09-24 US disclosed
US-20090239859-A1 PROTEIN KINASE MODULATORS SENHWA BIOSCIENCES, INC. (TW) 2009-09-24 US disclosed
WO-2009108912-A1 PROTEIN KINASE MODULATORS CYLENE PHARMACEUTICALS, INC. (US) 2009-09-03 WO 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-20120208792-A1 PROTEIN KINASE MODULATORS PIM1, PIM2, PIM3 DRD2 4603/4885KDM4E 736/4885ALDH1A1 3801/4885
US-20090239859-A1 PROTEIN KINASE MODULATORS PIM1, PIM2, PIM3 DRD2 4603/4885KDM4E 736/4885ALDH1A1 3801/4885

“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.